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À̱ٿ챳¼ö ¾÷Àû ¿ä¾à (2023-12-01)
Achievement Summary of Prof. Keun Woo Lee
  • Research / ¿¬±¸¾÷Àû:
    • 230+ International SCI Papers / 230+ ¿©ÆíÀÇ ±¹Á¦Çмú ³í¹® ¹ßÇ¥
    • 200+ Conference Presentations / 200 ¿©ÆíÀÇ ±¹³»¿Ü Çмú´ëȸ ¹ßÇ¥
    • 100+ Invited Talks / ¾à 100¿© °ÇÀÇ ±¹³»¿Ü ÃÊû°­¿¬
  • Patents / ƯÇã¾÷Àû:
    • 2 International (US) Patent Registrations / 2°ÇÀÇ ±¹Á¦(¹Ì±¹)ƯÇãµî·Ï
    • 3 Domestic Patent Registrations / 3°ÇÀÇ ±¹³»Æ¯Çãµî·Ï
    • 9 Domestic Patent Applications / 9°ÇÀÇ ±¹³»Æ¯ÇãÃâ¿ø
    • 2 Technology Transfers / 2°ÇÀÇ ±â¼úÀÌÀü
  • Education / ±³À°¾÷Àû:
    • 20+ Year College Teaching/Lectures/ 20¿©³â°£ ´ëÇб³À°/°­ÀÇ
    • 25+ Ph.D. Educating / 25¸íÀÇ »ý¸íÁ¤º¸ÇÐ ¹Ú»ç¹èÃâ
    • 12+ Master Educating / 12¸íÀÇ »ý¸íÁ¤º¸ÇÐ ¼®»ç ¹èÃâ
    • 12+ Postdoc/RAs Supporting / 12¸íÀÇ ¿¬±¸¿ø Áö¿ø
  • Service & Leadership / º¸Á÷ÇàÁ¤¾÷Àû:
    • 2 Years President of KSBi (Kor. Soc. for Bioinformatics) / 2³â°£ Çѱ¹»ý¸íÁ¤º¸ÇÐȸÀå
    • 3 Years Dean of College of Pharm. / 3³â°£ °æ»ó´ë ¾àÇдëÇÐÀå
    • 2 Years Dean of International Affair of GNU / 2³â°£ °æ»ó´ë ±¹Á¦±³·ùº»ºÎÀå
    • 6 International Conference Chair & Org. Chair / 6°³ ±¹Á¦Çмú´ëȸÀå & Á¶Á÷À§¿øÀå



Resume À̷¼­


Keun Woo Lee Ph.D   ÀÌ±Ù¿ì ±³¼ö



  Education Çз :
  • B.S.: Seoul National University (SNU), Chemistry /¼­¿ï´ëÇб³ È­ÇкΠÇлç 1988
  • M.S.: Seoul National University, Physical Chemistry /¼­¿ï´ëÇб³ È­ÇкΠÀÌÇм®»ç 1990
  • Ph.D.: Seoul National University, Computational Chemistry
    /¼­¿ï´ëÇб³ È­ÇкΠÀÌÇйڻç 1997 (ÀÌ·ÐÈ­ÇÐ/°è»êÈ­ÇÐ)

 Professional Careers °æ·Â :
  • SNU, Basic Science Research Center, Postdoc / ¼­¿ï´ë ±âÃÊ°úÇпø ¿¬±¸¿ø (1997)
  • UC Berkeley, Chemistry Dept., Postdoc / Ķ¸®Æ÷´Ï¾Æ¹öŬ¸®´ë È­Çаú ¿¬±¸¿ø (1997-1998)
  • Univ. of Houston, Biochemistry, RA & RA-Professor / ÈÞ½ºÅÏ´ë »ý¹°»ýÈ­Çаú ¿¬±¸¿ø/¿¬±¸±³¼ö (1998-2004)
  • USA Houston, VisiGen Biotech Inc., Sr. Scientist/ (¹Ì±¹ ÈÞ½ºÅÏ) Visigen ¹ÙÀÌ¿ÀÅØ ¼±ÀÓ¿¬±¸¿ø(2002-2004)
  • Gyeongsang National University (GNU), Division of Life Science, Assistant-/Associate-/Full-Professor/ °æ»ó±¹¸³´ëÇб³ ÀÚ¿¬°úÇдëÇÐ »ý¸í°úÇкΠ/ Á¶±³¼ö/ºÎ±³¼ö/±³¼ö (2004-) http://bio.gnu.ac.kr
  • CEO of AiDD (Angel i-Drug Design) / ¿£Á©½Å¾à¼³°è ´ëÇ¥ (2022-) http://drug1004.com

 Admin. Experiences ÇàÁ¤°æ·Â :
  • Dean of GNU Pharmaceutical College / °æ»ó´ë ¾àÇдëÇÐ (ÇÐÀå) ÃßÁø´ÜÀå ¿ªÀÓ (2012-2015)
  • Dean of GNU Graduate School of Food & Drug / °æ»ó´ë ½ÄÀǾàÇ° ´ëÇÑ¿øÀå ¿ªÀÓ (2014)
  • Vice Dean of GNU International Affair / °æ»ó´ë ±¹Á¦±³·ù/´ë¿ÜÇù·Âº»ºÎ ºÎº»ºÎÀ忪ÀÓ (2013-2014)
  • Vice Dean of College of Natural Science / °æ»ó´ë ÀÚ¿¬°úÇдëÇÐ ºÎÇÐÀå ¿ªÀÓ (2014-2015)


 Research Leader Career ¿¬±¸´ÜÀå°æ·Â :
  • In silico based Drug-Repositioning Server Development / »ê¾÷ÀÚ¿øºÎ "ÀνǸ®ÄÚ ±â¹Ý ½Å¾àÀçâÃâ ¼­¹ö ±¸Ãà»ç¾÷" ¼öÇà (2015)
  • Director of "AI-based Drug Design Platform Development" Center / °úÇбâ¼úºÎ "ÀΰøÁö´É±â¹Ý ½Å¾à¼³°è Ç÷§Æû ±¸Ãà»ç¾÷" »ç¾÷´ÜÀå ¼öÇà (2018 & 2019)
  • Director of "BK21 Four Bio Bigdata Center" / "¹ÙÀÌ¿ÀÀÇ·áºòµ¥ÀÌÅÍ»ç¾÷´Ü" BK21 4´Ü°è »ç¾÷´ÜÀå ¼öÇà (2020-)
  • President of KSBi(Korean Society for Bioinfomatics) /Çѱ¹»ý¸íÁ¤º¸ÇÐȸ 10´ë ȸÀå ¿ªÀÓ (2017 & 2018)


 Extra Careers ±âŸ°æ·Â :
  • Pioneer in In silico-based Drug Design(CADD) in Korea / ´ëÇÑÇѱ¹ ÄÄÇ»Åͽž༳°è ¿¬±¸ 1¼¼´ë ¹× µµÀÔ (1989-)
  • 30+ Year Photographer / »çÁøÀÛ°¡ (1987-)
  • 3 Year Car Racer / ÀÚµ¿Â÷°æÁÖ¼±¼ö (1993-1995)
  • Korea 1st Development of 'Global Academic Degree Program between GNU and MU(Univ. of Missouri)' / ´ëÇÑÇѱ¹ ÃÖÃÊ·Î ¹Ì±¹´ëÇÐÀÌ Çѱ¹´ëÇÐÇÐÁ¡À» ÀÎÁ¤ÇØ ÁÖ´Â ±Û·Î¹úÇÐÀ§ÇÁ·Î±×·¥ °³¹ß (2013)
  • Awardee of "The Bioinformation of the Year 2019" from KSBi / Á¦1ȸ "2019 ¿ÃÇØÀÇ »ý¸íÁ¤º¸Àλó" ¼ö»ó (2019)



 Expertise & Main Fields Ư±â & Àü¹®ºÐ¾ß :

    1. In silico Drug Design & Bioinformatics ÀνǸ®ÄÚ ½Å¾à¼³°è & »ý¹°Á¤º¸ÇÐ
    This hot field means the systematic molecular design using many different computational methods and now it is a rapidly growing area that globally covers the development of techniques for using software to analyse and integrate biological and medical data from many diverse sources. Again, in experience and achievement aspect, we are working at top level of Korea for this field study. Additionally, we are also working bioinformatics and AI- or ML-based drug design study too.
    ´Ù¾çÇÑ ÄÄÇ»Åͱâ¹ýµéÀ» È°¿ëÇÏ¿© ÇÕ¸®ÀûÀÌ°í ü°èÀûÀ¸·Î Ç×¾ÏÁ¦ ȤÀº Ç×»ýÁ¦°°Àº »õ·Î¿î ½Å¾à ȤÀº ½Å¾àÈĺ¸¹°ÁúÀ» µµÃâÇÏ´Â ¿¬±¸ºÐ¾ß·Î¼­ ÀÌºÐ¾ß ¿¬±¸¿¡ ±¹³»ÃÖ°í ¼öÁØÀÇ ¿¬±¸·Â°ú ¿¬±¸°æÇèÀ» º¸À¯ÇÏ°í ÀÖÀ½. ¾Æ¿ï·¯ °Å´ë ¹ÙÀÌ¿ÀDB¸¦ È°¿ëÇÑ ´Ù¾çÇÑ ¼­¿­ºÐ¼®°°Àº »ý¹°Á¤º¸ÇÐ ¿¬±¸¹× ÀÌµé ºÐ¾ßµé°ú ÀΰøÁö´É ¾Ë°í¸®µëÀ» È°¿ëÇÏ´Â ¿¬±¸µéµµ ÇÔ²² ¼öÇàÇÏ°í ÀÖÀ½:

    • 2D/3D QSAR (Quantitative Structure-Activity Relationships)/ 2D/3D Á¤·®Àû±¸Á¶È°¼º°ü°è ºÐ¼®
    • Developing Pharmacophore Model (PM) / Æĸ¶ÄÚÆ÷¾î ¸ðµ¨¸µ
    • Ligand based- or Receptor based- Drug Design
    • Vitual Screening & Lead Optimization / °¡»ó°Ë»ö & ¸®µå ÃÖÀûÈ­ ¿¬±¸
    • Drug Repositioning Study / ½Å¾àÀçâÃâ ¿¬±¸
    • Peptide Design and Stabilization / ÆéŸÀÌµå ¼³°è ¹× ¾ÈÁ¤È­ ¿¬±¸
    • Antibody Design / Ç×ü¼³°è¿¬±¸
    • ProTAC & Linker Design / ÇÁ·ÎŹ & ¸µÄ¿ ¼³°è¿¬±¸
    • Bioinformatics Study / »ý¹°Á¤º¸ ºÐ¼®¿¬±¸
    • Deep Learning for ADME & Toxicity Prediction

    2. Computational Biology (Molecular Modeling) ºÐÀڸ𵨸µ
    The most distinctive feature of this research field is to use computer for studying biological phenomena. The state of art modern computational methods for bioscience study. In experience and achievement aspect, we are working at top level of for this field study.
    °è»ê»ý¹°ÇРȤÀº ºÐÀڸ𵨸µÀ̶ó ºÒ¸®¿ì´Â, °í¼º´É ½´ÆÛÄÄÇ»Å͸¦ ÀÌ¿ëÇÑ ¹°¸®È­ÇÐÀûÀÎ ¸ðÀǽÇÇè°è»êÀ» ¼öÇàÇÏ¿© ´Ü¹éÁúÀ̳ª Çٻ갰Àº °Å´ëºÐÀÚµéÀÇ »óÈ£ÀÛ¿ëÀ̳ª ±¸Á¶º¯È­µî¿¡ ´ëÇÏ¿© ¿¬±¸ÇÏ´Â ºÐ¾ßÀÓ. ÀÌ ºÐ¾ß ¶ÇÇÑ ±¹³»ÃÖ°í¼öÁØÀÇ °æÇè°ú ¿¬±¸·ÂÀ» º¸À¯ÇÏ°í ÀÖÀ½. º¸´Ù Á¤¹ÐÇÑ ºÐ¼®À» À§ÇÏ¿© ÀÚÀ¯¿¡³ÊÁö °è»ê¹× ¾çÀÚ¿ªÇÐ °è»ê °°Àº º¸´Ù ¼öÁسôÀº °è»êÈ­ÇÐÀûÀÎ ¹æ¹ýµéµµ ÇÔ²² ¼öÇàÇÏ°í ÀÖÀ½:
    • Molecular Docking (MD)/ ºÐÀÚµµÅ·°è»ê
    • Molecular Dynamics Simulation (MDS) / ºÐÀÚµ¿·ÂÇиðÀǽÇÇè
    • Homology Modeling (HM) / È£¸ô·ÎÁö ¸ðµ¨¸µ (´Ü¹éÁú3Â÷±¸Á¶ ¿¹Ãø)
    • Binding Free Energy (dG) Calculations / °áÇÕÀÚÀ¯¿¡³ÊÁö °è»ê
    • Quantum Mechanics (QM) Calculations / ¾çÀÚ¿ªÇаè»ê
    • Etc



Full Lists of Research Achievements / ¿¬±¸¾÷Àû Àüü¸ñ·Ï
    List Contents / ¸ñ·Ï ³ª¿­¼ø¼­:

      0. Lab Publicity / ¿¬±¸½Ç ¾ð·Ð¼Ò°³ ---------------------------------------------- 3 Page

      1. Patents & Technology Transfer / ƯÇã ¹× ±â¼úÀÌÀü ( 5 + 2) --------------- 4 Page

      2. Research Papers / ¿¬±¸³í¹® (230+) ------------------------------------------ 5 Page

      3. Conference Presentations / ±¹³»¿Ü Çмú´ëȸ ¹ßÇ¥ (210+) ----------------- 25 Page

      4. Invited Talks / ÃÊû°­¿¬ (100+) ---------------------------------------------- 41 Page



0. Lab Publicity / ¿¬±¸½Ç ¾ð·Ð¼Ò°³
  • [10] À̱ٿ챳¼ö "ºòµ¥ÀÌÅÍ»ç¾÷´Ü" BK21 4´Ü°è »ç¾÷¼±Á¤ (2020³â) :
  • [9] À̱ٿ챳¼ö "Á¦1ȸ Å׶óÁ¨ ¿ÃÇØÀÇ »ý¸íÁ¤º¸Àλó ¼ö»ó" (2019³â) :
  • [5] "°æ»ó´ë-¹ÌÁÖ¸®´ë 3+2 ±Û·Î¹úÇÐÀ§ ÇÁ·Î±×·¥ °³¼³" ±â»ç (2013³â) :
    • °æ³²½Å¹® [PDF]
      À̱ٿ챳¼öÀÇ ±¹Á¦±³·ù ³ë·ÂÀ¸·Î ±¹³»ÃÖÃÊ·Î Çѱ¹´ëÇÐ ÇÐÁ¡À» ¹Ì±¹´ëÇÐÀÌ ÀÎÁ¤ÇØÁÖ´Â ±Û·Î¹ú ÇÐÀ§ÇÁ·Î±×·¥À» °³¹ßÇÔ.
  • [4] º» ¿¬±¸½Ç ´ëÇпø»ý ÀÌÀ±È£±º (Çö °íµ¿°úÇпø/KIAS ¿¬±¸¿ø) '¹Ì·¡ ±âÃÊ°úÇÐ Çٽɸ®´õ' ¼±Á¤ ±â»ç (2012³â) :
    • NSP Åë½Å [PDF] | °æÇâ½Å¹® [PDF]
      °úÇбâ¼úºÎ°¡ ÁغñÇÑ ³ëº§»ó Èĺ¸ÀÚ Áö¿ø »ç¾÷ÀÌ¶ó¼­ Àü±¹ÀûÀ¸·Î ¶ß°Å¿î °ü½ÉÀ» ¸ðÀº ÇÁ·Î±×·¥À¸·Î ¾à14´ë 1ÀÇ Àü±¹¸í¹®´ë»ýµé°úÀÇ °æÀïÀ» ¶Õ°í Áö¹æ´ë»ý Áß À¯ÀÏÇÏ°Ô 0¼±Á¤µÇ´Â Äè°Å¸¦ ¿Ã¸².
  • [3] º» ¿¬±¸½Ç Çкλý ¼Õ¿µ½Ä±º (Çö KAIST ¹Ú»ç°úÁ¤ ÀçÇÐÁß) ±¹Á¦ SCI ³í¹®Åõ°í ¼º°ø±â»ç (2010³â):
  • [1] À̱ٿ챳¼ö ³í¹®ÀÌ ¹Ì±¹È­ÇÐȸ(ACS)¿¡¼­ ±ÝÁÖÀÇ ³í¹®À¸·Î ¼±Á¤. (2004³â):
    • [ PDF ]
      À̱ٿ챳¼ö°¡ J. of Med. Chem. Àú³ÎÀÇ ¹ßÇ¥ÇÑ AIDS Ä¡·áÁ¦ °ü·Ã¿¬±¸°¡ (¾Æ·¡ ³í¹®¸ñ·Ï¿¡ 10¹ø° ³í¹®) ¼¼°èÃÖ´ëÇÐȸÀÎ ¹Ì±¹È­ÇÐȸ(ACS)¿¡¼­ "±ÝÁÖÀÇ ³í¹®"À¸·Î ¼±Á¤µÊ. (No. 10 JMC paper was publicized at American Chemical Society (ACS) magazine, Chemical & Engineering News, as the hottest scientific results of the week.) (2004³â)




    1. Patents & Technology Transfer / ƯÇã ¹× ±â¼úÀÌÀü

    A. International (US) Patents: 2 Registrations / ¹Ì±¹ ±¹Á¦Æ¯Çã µî·Ï 2°Ç

    • 2010: A. Volkov, C. Colbert, I. Pan, A. Kraltcheva, M. Reddy, N. Battulga, M. Rea, K. W. Lee, B. Mulder, S. Hardin "Method for Analyzing Dynamic Detectable Events at the Single Molecular Level." US Patent No. US7668697 (23-Feb-2010) [ PDF ]

    • 2010: S. A. Martinis, J. M. Briggs, R. S. Mursinna, K. W. Lee, T. L. Lincecum, C. Davis, M. Cui, A. M. Williams, J. A. Speidel, Y. Zhai "Method and Composition for Leucyl-tRNA Synthetases and Derivatives thereof That Activate and Aminoacylate Non-Leucine Amino Acids to tRNA Adaptor Molecules." US Patent No. US7785827 (31-Aug-2010) [ PDF ]

    B1. Domestic Patents: 3 Registration / ±¹³» ƯÇã µî·Ï 3°Ç

    • 2023-Patent Registration: À̱ٿì, "ºÎÅ×ÀÎ À¯µµÃ¼ ¶Ç´Â ÀÌÀÇ ¾àÇÐÀûÀ¸·Î Çã¿ë°¡´ÉÇÑ ¿°À» Æ÷ÇÔÇÏ´Â À¯¹æ¾ÏÀÇ ¿¹¹æ, °³¼± ¶Ç´Â Ä¡·á¿ë Á¶¼º¹°" µî·Ï¹øÈ£/ÀÏÀÚ: 1024968870000 (2023.02.02) (Ãâ¿ø¹øÈ£/ÀÏÀÚ: 1020200133519 (2020.10.15))

    • 2021-Patent Registration: À̱ٿì & ±èÁÖÇö, "3,4-´ÙÀÌÇÏÀ̵å·Î¾ÆÀ̼ÒÄû³î¸° À¯µµÃ¼, ÀÌÀÇ Á¦Á¶¹æ¹ý ¹× À̸¦ Æ÷ÇÔÇÏ´Â ÆÐÇ÷Áõ ¿¹¹æ ¶Ç´Â Ä¡·á¿ë Á¶¼º¹°" µî·Ï¹øÈ£/ÀÏÀÚ: 1022820820000 (2021.07.21) (Ãâ¿ø¹øÈ£/ÀÏÀÚ: 1020190161762 (2019.12.06))

    • 2018-Patent Registration: ±è¸í¿Á & À̱ٿì,"ÇÁ·Ñ¸± ¿Ã¸®°íÆéƼ´Ù¾ÆÁ¦ ¾ïÁ¦Á¦¸¦ À¯È¿¼ººÐÀ¸·Î ÇÔÀ¯ÇÏ´Â ÅðÇ༺³úÁúȯ ¿¹¹æ ¶Ç´Â Ä¡·á¿ë Á¶¼º¹°" µî·Ï¹øÈ£/ÀÏÀÚ: 1019135060000 (2018.10.24) (Ãâ¿ø¹øÈ£/ÀÏÀÚ: 1020170090784 (2017.07.18))

    B2. Domestic Patents: 9 Applications / ±¹³» ƯÇã Ãâ¿ø 9°Ç

    • 2020-Patent Applicaton: À̱ٿì, "½Å¾àÀçâÃâÀ» ÅëÇÑ »õ·Î¿î COVID-19 ¹× SARS-CoV Ä¡·á Èĺ¸¹°Áú ¹ß±¼" 10-2020-0174122

    • 2020-Patent Applicaton: À̱ٿì, "PARP ¾ïÁ¦Á¦ ±â¹Ý »õ·Î¿î COVID-19 ¹× SARS-CoV Ä¡·á Èĺ¸¹°Áú ¹ß±¼ " 10-2020-0174121

    • 2020-Patent Applicaton: À̱ٿì, "Mpro ´Ü¹éÁúÀ» ÀúÇØÇÏ´Â »õ·Î¿î COVID-19 Ä¡·á¿ë Èĺ¸¹°Áú ¹ß±¼" 10-2020-0106476

    • 2020-Patent Applicaton: À̱ٿì, "Mpro ´Ü¹éÁúÀ» ÀúÇØÇÏ´Â »õ·Î¿î COVID-19 Ä¡·á¿ë Èĺ¸¹°Áú ¹ß±¼" 10-2020-0106475

    • 2020-Patent Applicaton: À̱ٿì, "Mpro ´Ü¹éÁúÀ» ÀúÇØÇÏ´Â »õ·Î¿î COVID-19 Ä¡·á¿ë Èĺ¸¹°Áú ¹ß±¼" 10-2020-0093329

    • 2020-Patent Applicaton: À̱ٿì, "½Å¾àÀçâÃâÀ» ÅëÇÑ »õ·Î¿î COVID-19 ¹× SARS-CoV Ä¡·á Èĺ¸¹°Áú ¹ß±¼" 10-2020-0093328

    • 2020-Patent Applicaton: À̱ٿì, "¸Ó½Å·¯´×À» ÅëÇÑ QSAR ¸ðµ¨ ±¸Ãà ¹× À¥ ±â¹Ý ½Å¾àÈĺ¸¹°Áú µµÃâ Ç÷§Æû" 10-2020-0031386

    • 2016-Patent Applicaton: ¹Ú¼®ÁÖ, À̱ٿì, "1-µð¿Á½ÃÇí½ÃÅç À¯µµÃ¼ ¹× À̸¦ ÇÔÀ¯ÇÏ´Â ÀÚ°¡¸é¿ªÁúȯ ¶Ç´Â À̽İźÎÁúȯ Ä¡·á¿ë ¾àÇÐÀû Á¶¼º¹°" 10-2016-0164214

    • 2016-Patent Applicaton: ¹Ú¼®ÁÖ, À̱ٿì, "15-ÇÏÀ̵å·Ï½ÃÇÁ·Î½ºÅ¸±Û¶õµò Å»¼ö¼ÒÈ­È¿¼Ò ¾ïÁ¦Á¦·Î¼­ÀÇ ½Å±ÔÇÑ ÇìÅ׷λçÀÌŬ¸¯ È­ÇÕ¹° ¹× À̸¦ Æ÷ÇÔÇÏ´Â ¾àÇÐÀû Á¶¼º¹°" 10-2016-0164213

    C. Technology Transfer: 2 Case / ±â¼ú ÀÌÀü 2°Ç

    • 2012: À̱ٿì, "ºÐÀڸ𵨸µ ¿¬±¸½Ã½ºÅÛ ±¸Ãà" Transferred To Samsung Electronics Institute / »ï¼ºÀüÀÚ¿¡ ±â¼úÀÌÀü [ PDF (°è¾à¼­ÀϺÎ) ]

    • 2017: À̱ٿì, "ÆÐÇ÷Áõ Ä¡·á Èĺ¸¹°Áú ¹ß±¼" Transferred To Inje Univesity / ÀÎÁ¦´ë¿¡ ±â¼úÀÌÀü



    2. Research Papers / ¿¬±¸³í¹®: ±¹Á¦³í¹® ÃÑ230+ °Ç ¹ßÇ¥

    2023 (9 SCI papers + 3 SCI submitted )

    • [235]. Vikas Kumar, XXX, YYY, ZZZ, Keun Woo Lee, ¡°Molecular Modeling of BRD4BD2-MZ1/AT1-VHL-Cul2-RBX1-E2-ubiquitin Ligase Complex to Predict the Structural Basis of Targeted Protein Degradation using Molecular Dynamics Simulations¡± JJJJJ (2023.12) [ PDF ] (IF2022: X.XX). https://doi.org/xxxxx (Submitting)
    • [234]. Pooja, XXX, YYY, ZZZ, Keun Woo Lee, ¡°Identification new potential CDK9 inhibitors from natural compounds databases by in silico approaches¡± JJJJJ (2023.12) [ PDF ] (IF2022: X.XX). https://doi.org/xxxxx (Submitted))
    • [233]. Jaejin Shin, XXX, YYY, Keun Woo Lee, ZZZ, ¡°Neurotherapeutic Effects of Vutiglabridin as a Paraoxonase-2 Modulator in Preclinical Models of Parkinson's Disease¡± Science Translational Medicine (2023.12) [ PDF ] (IF2022: 19.343). https://doi.org/xxxxx (Submitted))
    • 232. Danishuddin, Mohammad Sarwar Jamal, Kyoung Seob Song, Keun Woo Lee*, Jong Joo Kim *, Yeong-Min Park ¡°Revolutionizing Drug Targeting Strategies: Integrating Artificial Intelligence and Structure-Based Methods in PROTAC Development¡± Pharmaceuticals (2023.11) [ PDF ] (IF2022: 4.6). https://doi.org/xxxxx (In press)
    • 231. Shailima Rampogu, Pallavi Badvel, Byung Hoon Jo, Yongseong Kim, Seon-Won Kim, Keun Woo Lee, ¡°A review on Millepachine and its derivatives as potential multitarget anticancer agents¡± Biochemical and Biophysical Research Communications 681:249-270 (2023.09) [ PDF ] (IF2021: 3.32). https://doi.org/10.16/j.bbrc.2023.09.044
    • (*230). Si Won Moon, Jeong Yoon Kim, Seung Hwan Lee, Se Young Im, Gihwan Lee, (Keun Woo Lee), and Ki Hun Park, ¡°New Class of Tyrosinase Inhibitors, Rotenoids, from Amorpha fruticosa¡± ACS Omega (2023.09) [ PDF ] (IF2021: 4.1). https://doi.org/10.1021/acsomega.3c03396 (*My name was intentionally missed.)
    • (*229). Jeong Yoon Kim, Peng Li, Gihwan Lee, Jeong Ho Kim, Abdul Bari Shah, Yong Hyun Lee, (Keun Woo Lee), and Ki Hun Park, ¡°Investigation of bacterial neuraminidase inhibition of xanthones bearing geranyl and prenyl groups from Cratoxylum cochinchinense¡± Frontiers in Chemistry (2023.08) [ PDF ] (IF2021: 5.5). https://doi.org/10.3389/fchem.2023.1245071 (*My name was intentionally missed.)
    • 228. Hossain, Abu Jubayer, Rokibul Islam, Jong-Bok Seo, Hwee-Seon Park, Jong-Il Kim, Vikas Kumar, Keun Woo Lee, and Jae-Bong Park, ¡°Association of Phosphorylated Pyruvate Dehydrogenase with Pyruvate Kinase M2 Promotes PKM2 Stability in Response to Insulin¡± International Journal of Molecular Sciences (2023.07) [ PDF ] (IF2021: 5.6). https://doi.org/10.3390/ijms241813697
    • 227. Shraddha Parate, Vikas Kumar, Jong Chan Hong, and Keun Woo Lee, ¡°Investigation of Macrocyclic mTOR Modulators of Rapamycin Binding Site via Pharmacoinformatics Approaches¡± Computational Biology and Chemistry 104(5):107875 (2023.04) [ PDF ] (IF2022: 3.75). https://doi.org/10.1016/j.compbiolchem.2023.107875
    • 226. Shailima Rampogu, Yongseong Kim, Seon-Won Kim, Keun Woo Lee, ¡°An overview on monkeypox virus: Pathogenesis, transmission, host interaction and therapeutics¡± Frontiers in Cellular and Infection Microbiology (2023.01) [ PDF ] (IF2021: 6.07). https://doi.org/10.3389/fcimb.2023.1076251
    • 225. Vikas Kumar, Raj Kumar, Shraddha Parate, Danishuddin, Ghiwan Lee, Moonhyuk Kwon, Seong-Hee Jeong, Hyeon-Su Ro, Keun Woo Lee, Seon-Won Kim, ¡°Identification of Activated Cdc42-Associated Kinase Inhibitors as Potential Anticancer Agents Using Pharmacoinformatic Approaches¡± Biomolecules (2023.01) [ PDF ] (IF2021: 6.06). https://doi.org/10.3390/biom13020217
    • 224. Shailima Rampogu, Baji Shaik, Ju Hyun Kim, Tae Sung Jung, Min Woo Ha, Keun Woo Lee, ¡°Explicit molecular dynamics simulation studies to discover novel natural compound analogues as Mycobacterium tuberculosis inhibitors¡± Heliyon 30:9(2):e13324. (2023.01) [ PDF ] (IF2022: 3.78). https://doi.org/10.1016/j.heliyon.2023.e13324

    2022 (15 SCI papers )

    • 223. Pooja Singh, Vikas Kumar, Gihwan Lee, Tae Sung Jung, Min Woo Ha, Jong Chan Hong, Keun Woo Lee, ¡°Pharmacophore-Oriented Identification of Potential Leads as CCR5 Inhibitors to Block HIV Cellular Entry¡± International Journal of Molecular Sciences (2022.12) [ PDF ] (IF2021: 5.923). https://doi.org/10.3390/ijms232416122
    • 222. Muhammad Idrees, Vikas Kumar, Abdul Majid Khan, Myeong-Don Joo, Keun Woo Lee, Sea-Hwan Sohn, Il-Keun Kong, ¡°Cycloastragenol activation of telomerase improves ¥â-Klotho protein level and attenuates age-related malfunctioning in ovarian tissues¡± Mechanisms of Ageing and Development (2022.11) [ PDF ] (IF2021: 5.49). https://doi.org/10.1016/j.mad.2022.111756
    • 221. Dong-Keon Lee, Taesam Kim, Junyoung Byeon, Minsik Park, Suji Kim, Joohwan Kim, Seunghwan Choi, Gihwan Lee, Chanin Park, Keun Woo Lee, Yong Jung Kwon, Jeong-Hyung Lee, Young-Guen Kwon & Young-Myeong Kim, ¡°REDD1 promotes obesity-induced metabolic dysfunction via atypical NF-¥êB activation¡± Nature Communications (2022.10) [ PDF ] (IF2021: 17.69). https://doi.org/10.1038/s41467-022-34110-1
    • 220. Danishuddin, Vikas Kumar, Ghiwan Lee, J. Yoo, Hyeon-Su Ro, Keun Woo Lee, ¡°An attention mechanism-based LSTM network for cancer kinase activity prediction¡± SAR and QSAR in Environmental Research (2022.09) [ PDF ] (IF2021: 3.68). https://doi.org/10.1080/1062936X.2022.2109062
    • 219. Gunjan Thakur, Vikas Kumar, Keun Woo Lee, Chungkil Won, ¡°Structural Insights and Development of LRRK2 Inhibitors for Parkinson¡¯s Disease in the Last Decade¡± Genes (2022.08) [ PDF ] (IF2021: 4.14). https://doi.org/10.3390/genes13081426
    • 218. Muhammad Idrees, Vikas Kumar, Abdul Majid Khan, Myeong-Don Joo, Zia Uddin, Keun Woo Lee, Il-Keun Kong, ¡°Hesperetin activated SIRT1 neutralizes cadmium effects on the early bovine embryo development¡± Theriogenology (2022.06) [ PDF ] (IF2021: 2.92). https://doi.org/10.1016/j.theriogenology.2022.06.008
    • 217. Vikas Kumar, Shraddha Parate, Danishuddin, Amir Zeb, Pooja Singh, Gihwan Lee, Tae Sung Jung, Keun Woo Lee, and Min Woo Ha, ¡°3D-QSAR Based Pharmacophore Modeling, Virtual Screening, and Molecular Dynamics Simulations for the Identification of Spleen Tyrosine Kinase Inhibitors¡± Frontiers in Cellular and Infection Microbiology (2022.06) [ PDF ] (IF2020: 5.29). https://doi.org/10.3389/fcimb.2022.909111
    • 216. Ulhas Sopanrao Kadam, Kien Hong Trinh, Vikas Kumar, Keun Woo Lee, Yuhan Cho, Mai-Huong Thi Can, Hyebi Lee, Yujeong Kim, Sundong Kim, Jaehee Kang, Jae-Yean Kim, Woo Sik Chung, Jong Chan Hong, ¡°Identification and Structural Analysis of Novel Malathion-specific DNA Aptameric Sensors Designed for Food Testing¡± Biomaterials (2022.06) [ PDF ] (IF2020: 12.47). https://doi.org/10.1016/j.biomaterials.2022.121617
    • (*215). Aizhamal Baiseitova, Gihwan Lee, Abdul Bari Shah, Sanghwa Yoon, Jeong Ho Kim, Yong Hyun Lee, (Keun Woo Lee), and Ki Hun Park, ¡°New Dihydrobenzoxanthone Derivatives with Bacterial Neuraminidase Inhibitory Activity Isolated from Artocarpus elasticus¡± Bioorganic Chemistry (2022.06) [ PDF ] (IF2021: 5.30). https://doi.org/10.1016/j.bioorg.2022.105978 (*My name was missed by accident.)
    • *214.Aizhamal Baiseitova, Yeong Jun Ban, Jeong Yoon Kim, Gihwan Lee, Abdul Bari Shah, Jeong Ho Kim, Yong Hyun Lee, (Keun Woo Lee), and Ki Hun Park, ¡°Soybean Phytochemicals Responsible for Bacterial Neuraminidase Inhibition and Their Characterization by UPLC-ESI-TOF/MS¡± Food & Function (2022.05) [ PDF ] (IF2020: 5.29). https://doi.org/10.1039/D2FO00537A (*My name was intentionally missed.)
    • 213. Apoorva M Kulkarni, Shraddha Parate, Gihwan Lee, Yongseong Kim, Tae Sung Jung, Keun Woo Lee, and Min Woo Ha, ¡°Computational Simulations Highlight the IL2R¥á Binding Potential of Polyphenol Stilbenes from Fenugreek¡± Molecules (2022.02) [ PDF ] (IF2020: 4.41). https://doi.org/10.3390/molecules27041215
    • 212. Shailima Rampogu, Gihwan Lee, Jun Sung Park, Keun Woo Lee, and Myeong Ok Kim, ¡°Molecular Docking and Molecular Dynamics Simulations Discover Curcumin Analogue as a Plausible Dual Inhibitor for SARS-CoV-2¡± International Journal of Molecular Science (2022.02) [ PDF ] (IF2020: 5.92). https://doi.org/10.3390/ijms23031771
    • 211. Apoorva M Kulkarni, Vikas Kumar, Shraddha Parate, Gihwan Lee, Sanghwa Yoon and Keun Woo Lee, ¡°Identification of New KRAS G12D Inhibitors through Computer-Aided Drug Discovery Methods¡± International Journal of Molecular Science (2022.01) [ PDF ] (IF2020: 5.92). https://doi.org/10.3390/ijms23031309
    • 210. Shraddha Parate, Vikas Kumar, Jong Chan Hong and Keun Woo Lee, ¡°Putative dual inhibitors of mTOR and RET kinase from natural products: Pharmacophore-based hierarchical virtual screening¡± Journal of Molecular Liquids (2022.01) [ PDF ] (IF2020: 6.16). https://doi.org/10.1016/j.molliq.2022.118562
    • 209. Shraddha Parate, Vikas Kumar, Jong Chan Hong and Keun Woo Lee, ¡°Investigating Natural Compounds against Oncogenic RET Tyrosine Kinase using Pharmacoinformatic approaches for Cancer Therapeutics¡± RSC Advances (2022.01) [ PDF ] (IF2020: 3.361). https://doi.org/10.1039/d1ra07328a

    2021 (18 SCI papers )

    • 208. Shraddha Parate, Vikas Kumar, Jong Chan Hong and Keun Woo Lee, ¡°Investigation of Marine-Derived Natural Products as Raf Kinase Inhibitory Protein (RKIP)- Binding Ligands¡± Marine Drugs (2021.10) [ PDF ] (IF2020: 5.118). https://doi.org/10.3390/md19100581
    • 207. Danishuddin, Vikas Kumar, Mohammad Faheem and Keun Woo Lee, ¡°A decade of machine learning-based predictive models for human pharmacokinetics: Advances and challenges Drug Discovery Today¡± Drug Discovery Today (2021.09) [ PDF ] (IF2020: 7.85). https://doi.org/10.1016/j.drudis.2021.09.013
    • 206. Vikas Kumar, Shraddha Parate, Gunjan Thakur, Ghiwan Lee, Hyeon-Su Ro, Yongseong Kim, Hong Ja Kim, Myeong Ok Kim and Keun Woo Lee, ¡°Identification of CDK7 Inhibitors from Natural Sources Using Pharmacoinformatics and Molecular Dynamics Simulations¡± Biomedicines (2021.09) [ PDF ] (IF2020: 6.08). https://doi.org/10.3390/biomedicines9091197
    • 205. Danishuddin, Vikas Kumar, Shraddha Parate, Ashutosh Bahuguna, Ghiwan Lee, Myeong Ok Kim and Keun Woo Lee, ¡°Development of Machine Learning Models for Accurately Predicting and Ranking the Activity of Lead Molecules to Inhibit PRC2 Dependent Cancer¡± Pharmaceuticals (2021.07) [ PDF ] (IF2020: 5.86). https://doi.org/10.3390/ph14070699
    • 204. Shailima Rampogu, Rajesh Goud Gajula and Keun Woo Lee, ¡°A comprehensive review on chemotherapeutic potential of galangin¡± Biomedicine & Pharmacotherapy (2021.06) [ PDF ] (IF2021: 7.42). https://doi.org/10.1016/j.biopha.2021.111808
    • 203. Shailima Rampogu, Gihwan Lee, Apoorva M Kulkarni, Donghwan Kim, Sanghwa Yoon, Myeong Ok Kim and Keun Woo Lee, ¡°Computational Approaches to Discover Novel Natural Compounds for SARS-CoV2 Therapeutics¡± ChemistryOpen (2021.05) [ PDF ] (IF2020: 2.91). https://doi.org/10.1002/open.202000332
    • 202. Shraddha Parate, Shailima Rampogu, Gihwan Lee, Jong Chan Hong, and Keun Woo Lee, ¡°Exploring the Binding Interaction of Raf Kinase Inhibitory Protein with the N-Terminal of C-Raf through Molecular Docking and Molecular Dynamics Simulation¡± Frontiers in Molecular Biosciences (2021.05) [ PDF ] (IF2020: 5.24). https://doi.org/10.3389/fmolb.2021.655035
    • 201. Shraddha Parate, Vikas Kumar, Danishuddin, Jong Chan Hong, and Keun Woo Lee, ¡°Computational Investigation Identified Potential Chemical Scaffolds for Heparanase as Anticancer Therapeutics¡± International Journal of Molecular Sciences (2021.05) [ PDF ] (IF2020: 5.92). https://doi.org/10.3390/ijms22105311
    • 200. Deepak Kumar, Raj Kumar, R. Ramajayam, Keun Woo Lee, and Dong-Soo Shin, ¡°Synthesis, Antioxidant and Molecular Docking Studies of (-)-Catechin Derivatives¡± Journal of the Korean Chemical Society (2021.04) [ PDF ](IF2020: X.XX No SCI). https://doi.org/10.5012/jkcs.2021.65.2.106
    • 199. Apoorva Kulkarni, Shailima Rampogu, and Keun Woo Lee, ¡°Computer-Aided Drug Discovery Identifies Alkaloid Inhibitors of Parkinson¡¯s Disease Associated Protein, Prolyl Oligopeptidase¡± Evidence-based Complementary and Alternative Medicine (2021.04) [ PDF ] (IF2020: 2.62). https://doi.org/10.1155/2021/6687572
    • 198. Shraddha Parate, Vikas Kumar, Jong Chan Hong, and Keun Woo Lee, ¡°Identification of Flavonoids as Putative ROS-1 Kinase Inhibitors Using Pharmacophore Modeling for NSCLC Therapeutics¡± Molecules (2021.04) [ PDF ] (IF2020: 4.41). https://doi.org/10.3390/molecules26082114
    • 197. Vikas Kumar, Shraddha Parate, Sanghwa Yoon, Ghiwan Lee, and Keun Woo Lee, ¡°Computational Simulations Identified Marine-Derived Natural Bioactive Compounds as Replication Inhibitors of SARS-CoV-2¡± Frontiers in Microbiology (2021.04) [ PDF ] (IF2020: 5.64). https://doi.org/10.3389/fmicb.2021.647295
    • 196. Shraddha Parate, Vikas Kumar, Gihwan Lee, Jong Chan Hong, and Keun Woo Lee, ¡°Marine-Derived Natural Products as ATP-Competitive mTOR Kinase Inhibitors for Cancer Therapeutics¡± Pharmaceuticals (2021.03) [ PDF ] (IF2020: 5.86). https://doi.org/10.3390/ph14030282
    • 195. Seong Min Kim, Shailima Rampogu, Preethi Vetrivel, Apoorva M Kulkarni, Sang Eun Ha, Hun Hwan Kim, Keun Woo Lee, and Gon Sup Kim ¡°Transcriptome Analysis of Sinensetin-treated Liver Cancer Cells guided by Biological Network Analysis¡± Oncology Letters (2021.03) [ PDF ] (IF2020: 2.96). https://doi.org/10.3892/ol.2021.12616
    • 194. K. Abraham Peele, Vikas Kumar, Shraddha Parate, Krupanidhi Srirama, Keun Woo Lee, and T.C. Venkateswarulu ¡°Insilico Drug Repurposing using FDA Approved Drugs against Membrane Protein of SARS-CoV-2¡± Journal of Pharmaceutical Sciences (2021.03) [ PDF ] (IF2020: 3.53). https://doi.org/10.1016/j.xphs.2021.03.004
    • 193. Vikas Kumar, Raj Kumar, Shraddha Parate, Sanghwa Yoon, Ghiwan Lee, Donghwan Kim, and Keun Woo Lee ¡°Identification of ACK1 Inhibitors as Anticancer Agents by using Computer-Aided Drug Designing¡± Journal of Molecular Structure (2021.02) [ PDF ] (IF2020: 3.19). https://doi.org/10.1016/j.molstruc.2021.130200
    • 192. Akalesh Kumar Verma, Vikas Kumar, Swta Singh, Bhablesh Ch. Goswami, Ihosvany Camps, Aishwarya Sekar, Sanghwa Yoon, and Keun Woo Lee ¡°Repurposing Potential of Ayurvedic Medicinal Plants Derived Active Principles against SARS-CoV-2 associated target proteins revealed by molecular docking, molecular dynamics and MM-PBSA studies¡± Biomedicine & Pharmacotherapy (2021.02) [ PDF ] (IF2020: 6.52). https://doi.org/10.1016/j.biopha.2021.111356
    • 191. Muhammad Idrees, Vikas Kumar, Myeong-Don Joo, Ali, Niaz Ali, Keun Woo Lee, and Il-Keun Kong, ¡°SHP2 Nuclear/Cytoplasmic Trafficking in Granulosa Cells Is Essential for Oocyte Meiotic Resumption and Maturation¡± Frontiers in Cell and Developmental Biology (2021.01) [ PDF ] (IF2020: 6.68). https://doi.org/10.3389/fcell.2020.611503

    2020 (9 SCI paper + 8 PA )

    • 2020: Patent Applicaton: À̱ٿì, "½Å¾àÀçâÃâÀ» ÅëÇÑ »õ·Î¿î COVID-19 ¹× SARS-CoV Ä¡·á Èĺ¸¹°Áú ¹ß±¼" 10-2020-0174122
    • 2020: Patent Applicaton: À̱ٿì, "PARP ¾ïÁ¦Á¦ ±â¹Ý »õ·Î¿î COVID-19 ¹× SARS-CoV Ä¡·á Èĺ¸¹°Áú ¹ß±¼ " 10-2020-0174121
    • 2020: Patent Applicaton: À̱ٿì, "DDX3¸¦ Ÿ°ÙÀ¸·Î ÇÏ´Â »õ·Î¿î Ç×¾ÏÄ¡·áÁ¦·Î¼­ÀÇ Butein À¯»ç È­ÇÕ¹° ¹ß°ß" 10-2020-0133519
    • 2020-Patent Applicaton: À̱ٿì, "Mpro ´Ü¹éÁúÀ» ÀúÇØÇÏ´Â »õ·Î¿î COVID-19 Ä¡·á¿ë Èĺ¸¹°Áú ¹ß±¼" 10-2020-0106476
    • 2020-Patent Applicaton: À̱ٿì, "Mpro ´Ü¹éÁúÀ» ÀúÇØÇÏ´Â »õ·Î¿î COVID-19 Ä¡·á¿ë Èĺ¸¹°Áú ¹ß±¼" 10-2020-0106475
    • 2020-Patent Applicaton: À̱ٿì, "Mpro ´Ü¹éÁúÀ» ÀúÇØÇÏ´Â »õ·Î¿î COVID-19 Ä¡·á¿ë Èĺ¸¹°Áú ¹ß±¼" 10-2020-0093329
    • 2020-Patent Applicaton: À̱ٿì, "½Å¾àÀçâÃâÀ» ÅëÇÑ »õ·Î¿î COVID-19 ¹× SARS-CoV Ä¡·á Èĺ¸¹°Áú ¹ß±¼" 10-2020-0093328
    • 2020-Patent Applicaton: À̱ٿì, "¸Ó½Å·¯´×À» ÅëÇÑ QSAR ¸ðµ¨ ±¸Ãà ¹× À¥ ±â¹Ý ½Å¾àÈĺ¸¹°Áú µµÃâ Ç÷§Æû" 10-2020-0031386
    • 190. Raj Kumar, Vikas Kumar, Keun Woo Lee, and Raj Kumar "A computational drug repurposing approach in identifying the cephalosporin antibiotic and anti-hepatitis C drug derivatives for COVID-19 treatment" Computers in Biology and Medicine (2020.12) [ PDF ] (IF2019: 3.434).
    • 189. Sagar Barage , A. Karthic , Rohit Bavi, Neetin Desaid, Raj Kumar, Vikas Kumar and Sagar H. Barage "Identification and characterization of novel RdRp and Nsp15 inhibitors for SARS-COV2 using computational approach" Journal of Biomolecular Structure and Dynamics (2020.11) [ PDF ] (IF2019: 3.31).
    • 188. Abdul Bari Shah, Sanghwa Yoon, Jeong Ho Kim, Kamila Zhumanova, Yeong Jun Ban, Keun Woo Lee, and Ki Hun Park "Effectiveness of cyclohexyl functionality in ugonins from Helminthostachys zeylanica to PTP1B and ¥á-glucosidase inhibitions" INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES (2020.10) [ PDF ] (IF2019: 5.162).
    • 187. Seong Min Kim, Sang Eun Ha, Ho Jeong Lee, Shailima Rampogu, Preethi Vetrivel, Hun Hwan Kim, Venu Venkatarame Gowda Saralamma, Keun Woo Lee, and Gon Sup Kim "Sinensetin Induces Autophagic Cell Death through p53-Related AMPK/mTOR Signaling in Hepatocellular Carcinoma HepG2 Cells" Nutrients (2020.08) [ PDF ] (IF2019: 4.546).
    • 186. Shailima Rampogu, Gihwan Lee, Ravinder Doneti, Keun Woo Lee "Short communication for targeting natural compounds against HER2 kinase domain as potential anticancer drugs applying pharmacophore based molecular modelling approaches- part 2." Computational Biology and Chemistry (2020.08) [ PDF ] (IF2019: 1.850).
    • 185. Rabia Mukhtar Rana, Shailima Rampogu, Noman Bin Abid, Amir Zeb, Shraddha Parate, Gihwan Lee, Sanghwa Yoon, Yumi Kim, Donghwan Kim, and Keun Woo Lee, "In Silico Study Identified Methotrexate Analog as Potential Inhibitor of Drug Resistant Human Dihydrofolate Reductase for Cancer Therapeutics." Molecules (2020.07) [ PDF ] (IF2019: 3.262).
    • 184. Youngjin Lee, Jongseo park, Gihwan Lee, Sanghwa Yoon, Choon Kee Min, Tae Gyun Kim, Takenori Yamamoto, Do Han Kim, Keun Woo Lee, and , Soo Hyun Eom "S92 phosphorylation induces structural changes in the N-terminus domain of human mitochondrial calcium uniporter." SCIENTIFIC REPORTS (2020.06) [ PDF ] (IF2019: 3.998).
    • 183. Shailima Rampogu, Seong Min Kim, Minky Son, Ayoung Baek, Chanin Park, Gihwan Lee, Yumi Kim, Gon Sup Kim, Ju Hyun Kim, Keun Woo Lee "A Computational Approach with Biological Evaluation: Combinatorial Treatment of Curcumin and Exemestane Synergistically Regulates DDX3 Expression in Cancer Cell Lines" Biomolecules (2020.06) [ PDF ] (IF2019: 4.082).
    • 182. Shailima Rampogu, Ayoung Baek, Minky Son, Chanin Park, Sanghwa Yoon, Shraddha Parate Keun Woo Lee, and Jeong Ho Park, "Discovery of Lonafarnib-Like Compounds: Pharmacophore Modeling and Molecular Dynamics Studies." ACS Omega (2020.01) [ PDF ] (IF2019: 2.870).

    2019 (11 SCI papers + 1 Patent Application )

    • 2019-Patent Applicaton: À̱ٿì, ±èÁÖÇö, "3,4-´ÙÀÌÇÏÀ̵å·Î¾ÆÀ̼ÒÄû³î¸° À¯µµÃ¼, Á¦Á¶¹æ¹ý ¹× ÆÐÇ÷Áõ ¿¹¹æ ¶Ç´Â Ä¡·á¿ë Á¶¼º¹°" 10-2019-0161762
    • 181. Shailima Rampogu, Shraddha Parate, Saravanan Parameswaran, Chanin Park, Ayoung Baek, Minky Son, Yohan Park, Seok Ju Park, Keun Woo Lee "Natural compounds as potential Hsp90 inhibitors for breast cancer-Pharmacophore guided molecular modelling studies" Computational Biology and Chemistry (2019.12) [ PDF ] (IF2018: 1.331).
    • 180. Bo Reum Song, Min Woo Ha, Donghwan Kim, Chanin Park, Keun Woo Lee, and Seung-Mann Paek, "Investigation of Grignard Reagent as an Advanced Base for Aza-Claisen Rearrangement." Molecules 24(24), 4597(2019.09) [ PDF ] (IF2018: 3.098).
    • 179. Janar Jenisa, Aizhamal Baiseitovab, Sang Hwa Yoon, Chanin Park, Jeong Yoon Kim, Zuo Peng Li, Keun Woo Lee, and Ki Hun Park, "Competitive a-glucosidase inhibitors, dihydrobenzoxanthones, from the barks of Artocarpus elasticus." Journal of Enzyme Inhibition and Medicinal Chemistry (2019.09) [ PDF ] (IF2018: 4.027).
    • 178. Amir Zeb, Minky Son, Sanghwa Yoon, Ju Hyun Kim, Seok Ju Park, Keun Woo Lee "Computational Simulations Identified Two Candidate Inhibitors of Cdk5/p25 to Abrogate Tau-associated Neurological Disorders." Computational and Structural Biotechnology Journal (2019.04) [ PDF ] (IF2017: 4.720).
    • 177. Minky Son, Haneul Lee, Cheolmin Jeon, Yujung Kang, Chanin Park, Keun Woo Lee, and Jeong Ho Park, "Tryptamine-Triazole Hybrid Compounds for Selective Butyrylcholinesterase Inhibition." Bulletin of The Korean Chemical Society (2019.04) [ PDF ] (IF2017: 0.522).
    • 176. Amir Zeb, Donghwan Kim, Sayed Ibrar Alam, Minky Son, Raj Kumar, Shailima Rampogu, Saravanan Parameswaran, Rahul Mahadev Shelake, Rabia Mukhtar Rana, Shraddha Parate, Jae-Yean Kim, and Keun Woo Lee, "Computational Simulations Identify Pyrrolidine-2,3-Dione Derivatives as Novel Inhibitors of Cdk5/p25 Complex to Attenuate Alzheimer¡¯s Pathology." Journal of Clinical Medicine (2019.04) [ PDF ] (IF2017: 5.583).
    • 175. Shailima Rampogu, Chanin Park, Doneti Ravinder, Minky Son, Ayoung Baek, Amir Zeb, Rohit Bavi, Raj Kumar, Gihwan Lee, Shraddha Parate, Smita C. Pawar, Yohan Park, Seok Ju Park, and Keun Woo Lee, "Pharmacotherapeutics and Molecular Mechanism of Phytochemicals in Alleviating Hormone-Responsive Breast Cancer." Oxidative Medicine and Cellular Longevity (2019.04) [ PDF ] (IF2017: 4.936).
    • 174. Shailima Rampogu, Ayoung Baek, Chanin Park, Minky Son, Shraddha Parate, Saravanan Parameswaran, Yohan Park, Ju Hyun Kim, Baji Shaik, Seok Ju Park, and Keun Woo Lee, "Discovery of Small Molecules that Target Vascular Endothelial Growth Factor Receptor2 (VEGFR2) Signalling Pathway Employing Molecular Modelling Studies." Cells (2019.03) [ PDF ] (IF2017: 4.829).
    • 173. Minky Son, Chanin Park, Shailima Rampogu, Amir Zeb, and Keun Woo Lee, "Discovery of Novel Acetylcholinesterase Inhibitors as Potential Candidates for the Treatment of Alzheimer¡¯s Disease." International Journal of Molecular Sciences (2019.02) [ PDF ] (IF2017: 3.687).
    • 172. Rabia Mukhtar Rana, Shailima Rampogu, Amir Zeb, Minky Son, Chanin Park, Gihwan Lee, Sanghwa Yoon, Ayoung Baek, Sarvanan Parameswaran, Seok Ju Park, and Keun Woo Lee, "In Silico Study Probes Potential Inhibitors of Human Dihydrofolate Reductase for Cancer Therapeutics." Journal of Clinical Medicine (2019.02) [ PDF ] (IF2017: 5.583).
    • 171. Yan Wang, Jeong Yoon Kim, Zuo Peng Li, Sang Hwa Yoon, Zia Uddin, Yeong Jun Ban, Keun Woo Lee Ki Hun Park, "Highly potent bacterial neuraminidase inhibitors, chromenone derivatives from Flemingia philippinensis" International Journal of Biological Macromolecules (2019.01) [ PDF ] (IF2018: 4.784).

    2018 (19 SCI papers + 1 Patent Registration (ƯÇãµî·Ï) + 1 PA (ƯÇãÃâ¿ø) )

    • 2018-Patent Registration: ±è¸í¿Á, À̱ٿì,"ÇÁ·Ñ¸± ¿Ã¸®°íÆéƼ´Ù¾ÆÁ¦ ¾ïÁ¦Á¦¸¦ À¯È¿¼ººÐÀ¸·Î ÇÔÀ¯ÇÏ´Â ÅðÇ༺³úÁúȯ ¿¹¹æ ¶Ç´Â Ä¡·á¿ë Á¶¼º¹°" 10-1913506 (µî·ÏÀÏ: 2018-10-24)
    • 2018-Patent Applicaton: ¹Ú¼®ÁÖ, À̱ٿì, "½Å±Ô ÆÐÇ÷Áõ Ä¡·á¿ë Á¶¼º¹°" 10-2018-0007680
    • 170. Shailima Rampogu, Amir Zeb, Ayoung Baek, Chanin Park, Minky Son, and Keun Woo Lee, "Discovery of potential plant derived peptide deformylase (PDF) inhibitors against multidrug resistance bacteria." Journal of Clinical Medicine (2018.12) [ PDF ] (IF2017: 5.583).
    • 169. Shailima Rampogu, Amir Zeb, Ayoung Baek, Chanin Park, Minky Son, , and Keun Woo Lee, "Discovery of potential plant derived peptide deformylase (PDF) inhibitors against multidrug resistance bacteria." Journal of Clinical Medicine (2018.12) [ PDF ] (IF2017: 5.583).
    • 168. Raj Kumar, Saravanan Parameswaran, Rohit Bavi, Ayoung Baek, Minky Son, Shailima Rampogu, Chanin Park, Gihwan Lee, Amir Zeb, Shraddha Parate, Rabia Mukhtar Rana, and Keun Woo Lee, "Investigation of novel chemical scaffolds targeting prolyl oligopeptidase for neurological therapeutics." Journal of Molecular Graphics and Modelling (2018.12) [ PDF ] (IF2017: 1.885).
    • 167. Fawad Ali Shah, Amir Zeb, Tahir Ali, Tahir Ali, Muhammad Faheem, Sayed Ibrar Alam, Kamran Saeed, Phil-Ok Koh, and Keun Woo Lee, Myeong Ok Kim, "Idetification of proteins differentially expressed in striatum by melatonin in middle cerebral artery occlusion model - a proteomic and in silico appraoch." Fronteirs in Neuroscience (2018.12) [ PDF ] (IF2017: 3.877).
    • 166. Amir Zeb, Chanin Park, Shailima Rampogu, Minky Son, GiHwan Lee, and Keun Woo Lee, "Structure-based Drug Designing Recommends HDAC6 Inhibitors to Attenuate Microtubule-associated Tau-pathogenesis." ACS Chemical Neurosciences (2018.11) [ PDF ] (IF2017: 4.211).
    • 165. Shailima Rampogu, Gihwan Lee, Ayoung Baek, Minky Son, Chanin Park, Amir Zeb, Sang Hwa Yoon, Suhyeon Park, and Keun Woo Lee, "Discovery of Non-Peptidic Compounds against Chagas Disease Applying Pharmacophore Guided Molecular Modelling Approaches." Molecules (2018.11) [ PDF ] (IF2017: 3.098).
    • 164. Shailima Rampogu, Guang Ping Cao, Rohit Bavi, Ayoung Beak, Minky Son, Raj Kumar, Chanin Park, Amir Zeb, and Keun Woo Lee, "Identification of Novel Scaffolds with Dual Role as Antiepileptic and Anti-Breast Cancer." Transactions on Computational Biology and Bioinformatics (2018.10) [ PDF ] (IF2017: 2.428).
    • 163. Ho Jeong Lee, Venu Venkatarame Gowda Saralamma, Seong Min Kim, Sang Eun Ha, Preethi Vetrivel, Eun Hee Kim, Snag Joon Lee, Jeong Doo Heo, Shailima Rampogu, Keun Woo Lee, Gon Sup Kim, "Comparative Proteomic Profiling of Tumor-associated Proteins in Human Gastric Cancer Cells Treated with Pectolinarigenin." Nutrients (2018.10) [ PDF ] (IF2017: 4.196).
    • 162. Shailima Rampogu, Chanin Park, Minky Son, Ayoung Beak, Amir Zeb, Gihwan Lee, Keun Woo Lee, "Modulation of aromatase by natural compounds-A pharmacophore guided molecular modelling simulations." South African Journal of Botany (2018.09) [ PDF ] (IF2017: 1.442).
    • 161. Shailima Rampogu, Saravanan Parameswaran, Mary Rampogu Lemuel, and Keun Woo Lee, "Exploring the Therapeutic Ability of Fenugreek against Type 2 Diabetes and Breast Cancer Employing Molecular Docking and Molecular Dynamics Simulations." Evidence-Based Complementary and Alternative Medicine (2018.07) [ PDF ] (IF2017: 2.064).
    • 160. Irfanullah, Amir Zeb, Naila Shinwari, Khadim Shah, Syed Zohaib Tayyab Gilani, Saadullah Khan, Keun Woo Lee, Syed Irfan Raza, Shabir Hussain, Khurram Liaqat, Wasim Ahmad, "Molecular and in silico analyses validates pathogenicity of homozygous mutations in the NPR2 gene underlying variable phenotypes of Acromesomelic dysplasia, type Maroteaux." International Journal Of Biochemistry & Cell Biology (2018.07) [ PDF ] (IF2017: 3.247).
    • 159. Shafiq Ur Rehman, Tahir Ali, Sayed Ibrar Alam, Rahat Ullah, & Amir Zeb, Bart P. F. Rutten, Keun Woo Lee, Myeong Ok Kim, "Ferulic Acid Rescues LPS-Induced Neurotoxicity via Modulation of the TLR4 Receptor in the Mouse Hippocampus." Molecular Neurobiology (2018.07) [ PDF ] (IF2017: 5.076).
    • 158. Raees Khan, Amir Zeb, Nazish Roy, Roniya Thapa Magar, Hyo Jeong Kim, Keun Woo Lee, and Seon-Woo Lee, "Biochemical and Structural Basis of Triclosan Resistance in a Novel Enoyl-Acyl Carrier Protein Reductase." Antimicrobial Agents And Chemotherapy (2018.06) [ PDF ] (IF2017: 4.255).
    • 157. Amir Zeb, Chanin Park, Minky Son, Shailima Rampogu, Ibrar Alam, and Keun Woo Lee, "Investigation of non-hydroxamate scaffolds against HDAC6 inhibition: A pharmacophore modeling, molecular docking, and molecular dynamics simulation approach." Journal of Bioinformatics and Computational Biology (2018.06) [ PDF ] (IF2017: 0.991).
    • 156. Amir Zeb, Chanin Park, Minky Son, Chanin Park, Yeongrae Cho, Donghwan Kim, Shailima Rampogu, Gihwan Lee, Youn-Sig Kwak, Seok Ju Park,and Keun Woo Lee, "Integration of Virtual Screening and Computational Simulation Identifies Photodynamic Therapeutics against Human Protoporphyrinogen Oxidase IX (hPPO)." Arabian Journal of Chemistry (2018.04) [ PDF ] (IF2017: 2.969).
    • 155. Shailima Rampogu, Minky Son, Ayoung Baek, Chanin Park, Rabia Mukthar Rana, Amir Zeb, Saravanan Parameswaran, and Keun Woo Lee, "Targeting natural compounds against HER2 kinase domain as potential anticancer drugs applying pharmacophore based molecular modelling approaches." Computational Biology and Chemistry 74:327-338 (2018.04) [ PDF ] (IF2017: 1.412).
    • 154. Shailima Rampogu, Ayoung Beak, Rajesh Goud Gajula, Amir Zeb, Rohit S. Bavi, Raj Kumar, Yongseong Kim, Yong Jung Kwon, and Keun Woo Lee, "Ginger (Zingiber officinale) phytochemicals-gingerenone-A and shogaol inhibit SaHPPK: molecular docking, molecular dynamics simulations and in vitro approaches." Annals of Clinical Microbiology and Antimicrobials 17:16 (2018.04) [ PDF ] (IF2017: 3.155).
    • 153. Shailima Rampogu, Ayoung Beak, Amir Zeb, and Keun Woo Lee, "Exploration for novel inhibitors showing back-to-front approach against VEGFR-2 kinase domain (4AG8) employing molecular docking mechanism and molecular dynamics simulations." BMC Cancer 18:264 (2018.03) [ PDF ] (IF2017: 3.288).
    • 152. Seokmin Kim,Yuno Lee, Songmi Kim, Sang Jik Lee, Phil Kyeong Heo, Siu Kim, Yong Jung Kwon, and Keun Woo Lee, "Identification of Novel Human HDAC8 Inhibitors by Pharmacophorebased Virtual Screening and Density Functional Theory Approaches." Bulletin of The Korean Chemical Society 39: 197-206 (2018.01) [ PDF ] (IF2017: 0.522).

    2017 (4 SCIs + 1 Non SCI + 1 Patent Application)

    • 2017-Patent Applicaton: ±è¸í¿Á, À̱ٿì,"ÇÁ·Ñ¸± ¿Ã¸®°íÆéƼ´Ù¾ÆÁ¦ ¾ïÁ¦Á¦¸¦ À¯È¿¼ººÐÀ¸·Î ÇÔÀ¯ÇÏ´Â ÅðÇ༺³úÁúȯ ¿¹¹æ ¶Ç´Â Ä¡·á¿ë Á¶¼º¹°" 10-2017-0090784
    • 151. Shailima Rampogu, Ayoung Baek, Minky Son, Amir Zeb, Chanin Park, Raj Kumar, Gihwan Lee, Donghwan Kim, Yeonuk Choi, Yeongrae Cho, Yohan Park, Seok Ju Park, Keun Woo Lee, "Computational Exploration for Lead Compounds That Can Reverse the Nuclear Morphology in Progeria." BioMed Research International 2017:5270940 (2017.10) [ PDF ] (IF2016: 2.476).
    • 150. Shailima Rampogu, Minky Son, Chanin Park, Hyong-Ha Kim, Jung-Keun Suh, and Keun Woo Lee, "Sulfonanilide Derivatives in Identifying Novel Aromatase Inhibitors by Applying Docking, Virtual Screening, and MD Simulations Studies." BioMed Research International 2017:2105610 (2017.10) [ PDF ] (IF2016: 2.476).
    • 149. Raj Kumar, Rohit Bavi, Min Gi Jo, Venkatesh Arulalapperumal, Ayoung Baek, Shailima Rampogu, Myeong Ok Kim, and Keun Woo Lee, "New compounds identified through in silico approaches reduce the synuclein expression by inhibiting prolyl oligopeptidase in vitro." Scientific Reports 7, 10827 (2017.09) [ PDF ] (IF2016: 4.259).
    • 148. Xue Fei Tan, Zia Uddin, Chanin Park, Yeong Hun Song, Minky Son, Keun Woo Lee,and Ki Hun Park, "Competitive protein tyrosine phosphatase 1B (PTP1B) inhibitors, prenylated caged xanthones from Garcinia hanburyi and their inhibitorymechanism." Bioorganic & Medicinal Chemistry 25(8):2498-2506 (2017.03) [ PDF ] (IF2016: 2.930).
    • 147. Sugunadevi Sakkiah, Guang Ping Cao, Satya P. Gupta, Seok Ju Park, and Keun Woo Lee, "Overview of the Structure and Function of Protein Kinases." Current Enzyme Inhibition 13, 81-88 (2017.01) [ PDF ] (IF2016: n/a Non SCI).

    2016 (11 SCI + 2 Patent Applications )

    • 2016-Patent Applicaton: ¹Ú¼®ÁÖ, À̱ٿì, "1-µð¿Á½ÃÇí½ÃÅç À¯µµÃ¼ ¹× À̸¦ ÇÔÀ¯ÇÏ´Â ÀÚ°¡¸é¿ªÁúȯ ¶Ç´Â À̽İźÎÁúȯ Ä¡·á¿ë ¾àÇÐÀû Á¶¼º¹°" 10-2016-0164214
    • 2016-Patent Applicaton: ¹Ú¼®ÁÖ, À̱ٿì, "15-ÇÏÀ̵å·Ï½ÃÇÁ·Î½ºÅ¸±Û¶õµò Å»¼ö¼ÒÈ­È¿¼Ò ¾ïÁ¦Á¦·Î¼­ÀÇ ½Å±ÔÇÑ ÇìÅ׷λçÀÌŬ¸¯ È­ÇÕ¹° ¹× À̸¦ Æ÷ÇÔÇÏ´Â ¾àÇÐÀû Á¶¼º¹°" 10-2016-0164213
    • 146. Jae Taek Lee, Seung Sik Lee, Suvendu Mondal, Bhumi Nath Tripathi, Siu Kim, Keun Woo Lee, Sung Hyun Hong, Hyoung-Woo Bai, Jae-Young Cho, and Byung Yeoup Chung, "Enhancement of the Chaperone Activity of Alkyl Hydroperoxide Reductase C from Pseudomonas aeruginosa PAO1 Resulting from a Point-Specific Mutation Confers Heat Tolerance in Escherichia coli." Molecules and Cells 39(8), 594-603 (2016.10) [ PDF ] (IF2015: 2.670).
    • 145. Guang Ping Cao, Sundarapandian Thangapandian, Minky Son, Raj Kumar, Yeung-Joon Choi, Yongseong Kim, Yong Jung Kwon, Hyong-Ha Kim, Jung-Keun Suh, Keun Woo Lee "QSAR Modeling to Design Selective Histone Deacetylase 8 (HDAC8)Inhibitors." Archives of Pharmacal Research 29(10), 1356-1369 (2016.08) [ PDF ] (IF2015: 2.490).
    • 144. Rohit Bavi, Raj Kumar, Shailima Rampogu, Minky Son, Chanin Park, Ayoung Baek,Hyong-Ha Kim, Jung-Keun Suh, Seok Ju Park, Keun Woo Lee, "Molecular Interactions of UvrB Protein and DNA from Helicobacter pylori: Insight into a Molecular Modeling Approach." Computers in Biology and Medicine 75, 181-189 (2016.08) [ PDF ] (IF2015: 1.521).
    • 143. Rohit Bavi, Raj Kumar, Shailima Rampogu, Yongseong Kim, Yong Jung Kwon, Seok Ju Park, Keun Woo Lee, "Novel Virtual Lead Identification in the Discovery of Hematopoietic Cell Kinase (HCK) Inhibitors: Application of 3D QSAR and Molecular Dynamics Simulation." Journal of Receptors and Signal Transduction 1-16 (2016.08) [ PDF ] (IF2015: 1.782).
    • 142. A-Reum Jeong, Si-Seok Lee, Yun-Jeong Han, Ah-Young Shin, Ayoung Baek, Taeho Ahn, Min-Gon Kim,Young Soon Kim, Keun Woo Lee, Akira Nagatani, and Jeong-Il Kim, "New Constitutively Active Phytochromes Exhibit Light-Independent Signaling Activity." Plant Physiology 171(4) 2826-2840 (2016.08) [ PDF ] (IF2015: 6.628).
    • 141. Akhtar Ali, Natalia Raddatz, Rashid Aman, Songmi Kim, Hyeong Cheol Park, Masood Jan, Dongwon Baek, Irfan Ullah Khan, Dong-Ha Oh, Sang Yeol Lee, Ray A. Bressan, Keun Woo Lee, Albino Maggio, Jose M. Pardo, Hans J. Bohnert, and Dae-Jin Yun, "A Single Amino-Acid Substitution in the Sodium Transporter HKT1 Associated with Plant Salt Tolerance." Plant Physiology 171(3) 2112-2126 (2016.07) [ PDF ] (IF2015: 6.628).
    • 140. Ah-Young Shin, Yun-Jeong Han, Ayoung Baek, Taeho Ahn, Soo Young Kim, Thai Son Nguyen, Minky Son, Keun Woo Lee, Yu Shen, Pill-Soon Song, and Jeong-Il Kim, "Evidence that phytochrome functions as a protein kinase in plant light signaling." Nature Communications (2016.05) [ PDF ] (IF2015: 11.329).
    • 139. Y. H. Song, D. W. Kim, M. J. Curtis-Long, C. Park, M. Son, J. Y. Kim, H. J. Yuk, K. W. Lee, and K. H. Park, "Cinnamic acid amides from Tribulus terrestris displaying uncompetitive a-glucosidase inhibition." European Journal of Medicinal Chemistry 114, 201-208 (2016.05) [ PDF ] (IF2015: 3.902).
    • 138. Y. Kim, M. Son, E.-Y. Noh, S. Kim, C. Kim, J.-H. Yeo, C. Park, K. W. Lee, and W. Y. Bang, "MP-V1 from the Venom of Social Wasp Vespula vulgaris Is a de Novo Type of Mastoparan that Displays Superior Antimicrobial Activities." Molecules 21(4), 512 (10 pages) (2016.04) [ PDF ] (IF2015: 2.465).
    • 137. X. Tan, Y. H. Song, C. Park, K.-W. Lee, J. Y. Kim, D. W. Kim, K. D. Kim, K. W. Lee, M. J. Curtis-Long, and K. H. Park, "Highly potent tyrosinase inhibitor, neorauflavane from Campylotropis hirtella and inhibitory mechanism with molecular docking." Bioorganic & Medicinal Chemistry 24(2), 153-159 (2016.01) [ PDF ] (IF2015: 2.923).
    • 136. R. Bavi, R. Kumar, L. Choi, and K. W. Lee, "Exploration of Novel Inhibitors for Bruton's Tyrosine Kinase by 3D QSAR Modeling and Molecular Dynamics Simulation." PLoS One 11(1), e0147190 (2016. 01) [ PDF ] (IF2015: 3.057).

    2015 (15 = 14 SCI + 1)

    • 135. Yoo-Sup Lee, Jinhyuk Lee, Kyoung-Seok Ryu, Yuno Lee, Tai-Geun Jung, Jeong-Hwa Jang, Dae-Won Sim, Eun-Hee Kim, Min-Duk Seo, Keun Woo Lee, Hyung-Sik Won, "Semi-empirical structure determination of Escherichia coli Hsp33 and identification of dynamic regulatory elements for the activation process." Journal of Molecular Biology 427(24), 3850-3861 (2015.12) [ PDF ] (IF2014: 4.333).
    • 134. Rengarajan Kavitha,Subramanian Karunagaran,Subramaniam Subhash Chandrabose, Keun Woo Lee,Chandrasekaran Meganathan, "Pharmacophore modeling, virtual screening, molecular docking studies and density functional theory approaches to identify novel ketohexokinase (KHK) inhibitors." Biosystems 138, 39-52 (2015.12) [ PDF-tmp ] (IF2015: 1.548).
    • 133. B. C. An, S. S. Lee, H. S. Jung, J. Y. Kim, Y. Lee, K. W. Lee, S. Y. Lee, B. N. Tripathi, B. Y. Chung, "An additional cysteine in a typical 2-Cys peroxiredoxin of Pseudomonas promotes functional switching between peroxidase and molecular chaperone." FEBS Letters 589 (19, Part B), 2831-2840 (2015.09) [ PDF ] (IF2014: 3.169).
    • 132. Eun Mi Lee, Seung Sik Lee, Bhumi Nath Tripathi, Hyun Suk Jung, Guang Ping Cao, Yuno Lee, Sudhir Singh, Sung Hyun Hong, Keun Woo Lee, Sang Yeol Lee, Jae-Young Cho, and Byung Yeoup Chung, "Site-directed mutagenesis substituting cysteine for serine in 2-Cys peroxiredoxin (2-Cys Prx A) of Arabidopsis thaliana effectively improves its peroxidase and chaperone functions." Annals of Botany 116(4), 713-725 (2015.09) [ PDF ] (IF2014: 3.654).
    • 131. W. K. Cho, T. K. Hyun, D. Kumar, Y. Rim, X. Y. Chen, Y. Jo, S. Kim, K. W. Lee, Z.-Y. Park, W. J. Lucas, J.-Y. Kim, "Proteomic analysis to identify tightly-bound cell wall protein in rice calli." Molecules and Cells 38(8), 685-696 (2016.08) [ PDF ] (IF2014: 2.090).
    • 130. C. Xie,S. Choung, G.P. Cao, K. W. Lee, Y. J. Choi, "In silico investigation of action mechanism of four novel angiotensin-I converting enzyme inhibitory peptides modified with Trp." Journal of Functional Foods 17, 632-639 (2015.06) [ PDF ] (IF2014: 3.574).
    • 129. R. Kumar, M. Son, R. Bavi, Y. Lee, C. Park, V. Arulalapperumal, G. P. CAO, H.-H. Kim, J. Suh, Y. Kim, Y. J. Kwon, K. W. Lee, "Novel chemical scaffolds of the tumor marker AKR1B10 inhibitors discovered by 3D QSAR pharmacophore modeling." Acta Pharmacologica Sinica 36(8), 998-1012 (2015.08) [ PDF ] (IF2014: 2.496).
    • 128. M. Arooj, S. Sakkiah, G. P. Cao, S. Kim V. Arulalapperumal, K. W. Lee, "Finding off-targets, biological pathways & target diseases for chymase inhibitors via structure-based systems biology approach." Proteins: Structure, Function and Genetics 83(7), 1209-24 (2015.07) [ PDF ] (IF2014: 2.627).
    • 127. G.P. Cao, M. Arooj, S. Thangapandian, C. Park, V. Arulalapperumal, Y. Kim, Y.J. Kwon, H.H. Kim, J.K. Suh, and K. W. Lee, "A lazy learning-based QSAR classification study for screening potential histone deacetylase 8 (HDAC8) inhibitors." SAR and QSAR in Environmental Research 26(5), 397-420 (2015.05) [ PDF ] (IF2014: 1.596).
    • 126. S. S. Ghatge, A. A. Telke, T. R. Waghmode, Y. Lee, K. W. Lee, D-B Oh, H-D Shin, S-W Kim, "Multifunctional cellulolytic auxiliary activity protein HcAA10-2 from Hahella chejuensis enhances enzymatic hydrolysis of crystalline cellulose." Applied Microbiology and Biotechnology 99, 3041-3055 (2015.04) [ PDF ] (IF2014: 3.337).
    • 125. J. Hong, H. Kim, C. Park, M. Son, K. W. Lee, and Y. J. Kim, "Identification of Undifferentiated Embryonic Cell Transcription Factor 1 as a Potential Substrate of Carboxyl-Terminal Domain Small Phosphatases." Journal of the Korean Chemical Society 59(2), 188-193 (2015.02) [ PDF ] (IF2013: n/a).
    • 124. M. Arooj, K. W. Lee, "Binding mode analysis of dual inhibitors of human thymidylate synthase and dihydrofolate reductase as antitumour agents via molecular docking and DFT studies." Molecular Simulation 41(4), 311-314 (2015.02) [ PDF ] (IF2013: 1.119).
    • 123. D. H. Kim, H-J Ihn, C. Moon, S-S Oh, S. Park, S. Kim, K. W. Lee, K. D. Kim, "Ciglitazone, a Peroxisome Proliferator-Activated Receptor Gamma Ligand, Inhibits Proliferation and Differentiation of Th17 Cells." Biomolecules & Therapeutics 23(1), 71-76 (2015.02) [ PDF ] (IF2013: 0.841).
    • 122. J. Roh, S. J. Byun, Y. Seo, M. Kim, J-H Lee, S. Kim, Y. Lee, K. W. Lee, J-K Kim, M-H Kwon, "Generation of a chickenized catalytic anti-nucleic acid antibody bycomplementarity-determining region grafting." Molecular Immunology 63(2), 513-520 (2015.02) [ PDF ] (IF2013: 3.003 ).
    • 121. Minky Son, Chanin Park, Seul Gi Kwon, Woo Young Bang, Sam Woong Kim, Chul Wook Kim and Keun Woo Lee, "Structural importance of the C-terminal region in pig aldo-keto reductase family 1 member C1 and their effects on enzymatic activity." BMC Structural Biology 15(1), 1-10 (2015.02) [ PDF ] (IF2013: 2.222).


    2014 (9 SCI)

    • 120. S. Sakkiah, M. Arooj, K. W. Lee, J. Z. Torres, "Theoretical approaches to identify the potent scaffold for human sirtuin1 activator: Bayesian modeling and density functional theory." Medicinal Chemistry Research 23(9), 3998-4010 (2014.09) [ PDF ] (IF2013: 1.612).
    • 119. S. Sakkiah, S. Senese, Q. Yang, K. W. Lee, J. Z. Torres, "Dynamic and Multi-Pharmacophore Modeling for Designing Polo-Box Domain Inhibitors." PLoS One 9(7), e101405 (2014.07) [ PDF ] (IF2013: 3.534).
    • 118. Y. Lee, J. J. Lee, S. Kim, S. C. Lee, J. Han, W. Heu, K. Park, H. J. Kim, H. K. Cheong, D. Kim, H. S. Kim, K. W. Lee, "Dissecting the Critical Factors for Thermodynamic Stability of Modular Proteins Using Molecular Modeling Approach." PLoS One 9(5), e98243 (2014.05) [ PDF ] (IF2013: 3.534).
    • 117. S. S. Ghatge, A. A. Telke, S. H. Kang, V. Arulalapperumal, K. W. Lee, S. P. Govindwar, Y. Um, D. B. Oh, H. D. Shin, S. W. Kim, "Characterization of modular bifunctional processive endoglucanase Cel5 from Hahella chejuensis KCTC 2396." Applied Microbiology and Biotechnology 98(10), 4421-4435 (2014.05) [ PDF ] (IF2013: 3.811).
    • 116. M. Son, W. Y. Bang, C. Park, Y. Lee, S. G. Kwon, S. W. Kim, C. W. Kim, K. W. Lee, "Functional Mechanism of C-terminal Tail in the Enzymatic Role of Porcine Testicular Carbonyl Reductase: a combined experiment and molecular dynamics simulation study of the C-terminal tail in the enzymatic role of PTCR." PLoS One 9(3), e90712 (2014.03) [ PDF ] (IF2013: 3.534).
    • 115. S. Sakkiah, V. Arulalapperumal, S. Hwang, K. W. Lee, "Ligand-based Pharmacophore Modeling and Bayesian Approaches to Identify c-Src Inhibitors." Journal of Enzyme Inhibition and Medicinal Chemistry 29(1), 69-80 (2014.02) [ PDF ] (IF2013: 2.383).
    • 114. S. John, S. Thangapandian, P. Lazar, M. Son, C. Park, K. W. Lee, "New insights in the activation of human cholesterol esterase to design potent anti-cholesterol drugs." Molecular Diversity 18(1), 119-131 (2014.02) [ PDF ] (IF2013: 2.544).
    • 113. J. Chen, W. Y. Bang, Y. Lee, S. Kim, K. W. Lee, S. W. Kim, Y. S. Son, D. W. Kim, S. Akhter, J. D. Bahk, "AtObgC-AtRSH1 interaction may play a vital role in stress response signal transduction in Arabidopsis." Plant Physiology and Biochemistry 74, 176-184 (2014.01) [ PDF ] (IF2013: 2.352).
    • 112. Y. Lee, S. Kim, J. Y. Kim, M. Arooj, S. Kim, S. Hwang, B. W. Kim, K. H. Park, K. W. Lee, "Binding Mode Analyses and Pharmacophore Model Development for Stilbene Derivatives as a Novel and Competitive Class of a-Glucosidase Inhibitors." PLoS One 9(1), e85827 (2014.01) [ PDF ] (IF2013: 3.534).

    2013 (16 = 13 SCI + 3 ISI)

    • 111. M. Son, A. Baek, S. Sakkiah, C. Park. S. John, K. W. Lee, "Exploration of Virtual Candidates for Human HMG-CoA Reductase Inhibitors Using Pharmacophore Modeling and Molecular Dynamics Simulations." PLoS One 8(12), e83496 (2013.12) [ PDF ] (IF2012: 3.73).
    • 110. Y. J. Jung, Y. H. Chi, H. B. Chae, M. R. Shin, E. S. Lee, J. Y. Cha, S. K. Paeng, Y. Lee, J. H. Park, W. Y. Kim, C. H. Kang, K. O. Lee, K. W. Lee, D. J. Yun, S. Y. Lee, "Analysis of Arabidopsis thioredoxin-h isotypes identifies discrete domains that confer specific structural and functional properties." Biochemical Journal 456(1), 13-24 (2013.11) [ PDF ] (IF2012: 4.654).
    • 109. Y. Sohn, C. Park, Y. Lee, S. Kim, S. Thangapandian, Y. Kim, H. H. Kim, J. K. Sub, K. W. Lee, "Multi-conformation dynamic pharmacophore modeling of theperoxisome proliferator-activated receptor  for the discovery ofnovel agonists." Journal of Molecular Graphics & Modelling 46, 1-9 (2013.11) [ PDF ] (IF2012: 2.325).
    • 108. S. Hwang, S. Thangapandian, K. W. Lee, "Molecular Dynamics Simulations of Sonic Hedgehog-Receptor and Inhibitor Complexes and Their Applications for Potential Anticancer Agent Discovery." PLoS One 8(7), e68271 (2013.07) [ PDF ] (IF2012: 3.73).
    • 107. S. Lee, Y. Lee, James M. Briggs, K. W. Lee, "Pharmacophore Models of Paclitaxel- and Epothilone-Based Microtubule Stabilizing Agents." Bulletin of the Korean Chemical Society 34(7), 1972-1984 (2013.07) [ PDF ] (IF2012: 0.982).
    • 106. M. Arooj, S. Sakkiah, S. Sakkiah, V. Arulalapperumal, K. W. Lee, "A Combination of Receptor-Based Pharmacophore Modeling & QM Techniques for Identification of Human Chymase Inhibitors." PLoS One 8(4), e63030 (2013.04) [ PDF ] (IF2012: 3.73).
    • 105. M. Arooj, S. Kim, S. Sakkiah, G. Cao, Y. Lee, K. W. Lee, "Molecular Modeling Study for Inhibition Mechanism of Human Chymase and Its Application in Inhibitor Design." PLoS One 8(4), e62740 (2013.04) [ PDF ] (IF2012: 3.73).
    • 104. M. Arooj, S. Sakkiah, G. Cao, K. W. Lee, "An Innovative Strategy for Dual Inhibitor Design and Its Application in Dual Inhibition of Human Thymidylate Synthase and Dihydrofolate Reductase Enzymes." PLoS One 8(4), e60470 (2013.04) [ PDF ] (IF2012: 3.73).
    • 103. S. Sakkiah, M. Arooj, G. Cao, K. W. Lee, "Insight the C-Site Pocket Conformational Changes Responsible for Sirtuin 2 Activity Using Molecular Dynamics Simulations." PLoS One 8(3), e59278 (2013.03) [ PDF ] (IF2012: 3.73).
    • 102. S. Kim, Y. Lee, H-M. Tak, H-J. Park, Y-S. Sohn, S. Hwang, J. Han, D. Kang, K. W. Lee, "Identification of blocker binding site in mouse TRESK by molecular modeling and mutational studies." BBA-Biomembranes 1828(3), 1131-1142 (2013.03) [ PDF ] (IF2011: 3.99).
    • 101. M. chandrasekaran, S. Sakkiah, Y. Lee, J. V. Narayanan, K. W. Lee, "Discovery of potent inhibitors for interleukin-2-inducible T-cell kinase: structure-based virtual screening and molecular dynamics simulation approaches." Journal of Molecular Modeling 19(2), 715-726 (2013.02) [ PDF ] (IF2011: 1.797).
    • 100. K. W. Lee, , M. Son, C. Park, A. Baek, "Molecular Mechanism of Amino Acid Discrimination for the Editing Reaction of E.coli Leucyl-tRNA Synthetase." World Academy of Science, Engineering and Technology 7(1), 362-367 (2013.01) [ PDF ] (IF2011: ).
    • 99. C. Park, S. Thangapandian, Y. Lee, M. Son, S. John, Y Sohn, K. W. Lee, "Molecular Dynamic Simulation and Receptor-based Pharmacophore Modeling on Human Renin for Discovery of Novel Inhibitors." World Academy of Science, Engineering and Technology 7(1), 33-38 (2013.01) [ PDF ] (IF2011: ).
    • 98. M. Son, C. Park, A. Baek, S. John, K. W. Lee, "Discovery of Human HMG-Coa Reductase Inhibitors using Structure-Based Pharmacophore Modeling Combined with Molecular Dynamics Simulation Methodologies." World Academy of Science, Engineering and Technology 7(1), 23-28 (2013.01) [ PDF ] (IF2011: ).
    • 97. S. Sakkiah, M. Arooj, R. Kumar, S. H. Eom, K. W. Lee, "Identification of Inhibitor Binding Site in Human Sirtuin 2 Using Molecular Docking and Dynamics Simulations." PLoS One 8(1), e51429 (2013.01) [ PDF ] (IF2011: 4.092).
    • 96. S. Thangapandian, S. Sohn, M. Son, V. Arulalapperumal, K. W. Lee, "Development of predictive quantitative structure?activity relationship model and its application in the discovery of human leukotriene A4 hydrolase inhibitors." Future Medicinal Chemistry 5(1), 27-40 (2013.01) [ PDF ] (IF2011: 2.522).

    2012 (22 SCI + 1 Technolgy Transfer)

    • ±â¼úÀÌÀü: À̱ٿì, "ºÐÀڸ𵨸µ ¿¬±¸½Ã½ºÅÛ ±¸Ãà" Transferred To Samsung Electronics Institute / »ï¼ºÀüÀÚ¿¡ ±â¼úÀÌÀü [ PDF (°è¾à¼­ÀϺÎ) ]
    • 95. M. Kim, K. W. Lee, A. Cho, "Elucidation of Allosteric Inhibition Mechanism of 2-Cys Human Peroxiredoxin by Molecular Modeling." Journal of Chemical Information and Modeling 52(12), 3278-3283 (2012.12) [ PDF ] (IF2011: 4.675).
    • 94. M. chandrasekaran, S. Sakkiah, K. W. Lee, "Combined chemical feature-based assessment and Bayesian model studies to identify potential inhibitors for Factor Xa." Medicinal Chemistry Research 21(12), 4083-4099 (2012.12) [ PDF ] (IF2011: 1.271).
    • 93. M. Arooj, S. Thangapandian, S. John, S. Hwang, J. K. Park, K. W. Lee, "Computational Studies of Novel Chymase Inhibitors Against Cardiovascular and Allergic Diseases: Mechanism and Inhibition." Chemical Biology & Drug Design 80(6), 862-875 (2012.12) [ PDF ] (IF2011: 2.282).
    • 92. S. Thangapandian, S. Sohn, Y. Lee, V. Arulalapperumal, K. W. Lee, "Molecular Modeling Study on Tunnel Behavior in Different Histone Deacetylase Isoforms." PLoS One 7(11), e49327 (2012.11) [ PDF ] (IF2011: 4.092).
    • 91. S. Thangapandian, S. John, K. W. Lee, "Classical and 3D QSAR studies on inverse agonists of human histamine H1 receptor." Molecular Simulation 38(13), 1143-1156 (2012.11) [ PDF ] (IF2011: 1.328).
    • 90. Y. Lee, S. Kim, P. Lazar, J. Moon, S. Hwang, S. Thangapandian, Y. Shon, K. O. Lee, S. Y. Lee, K. W. Lee, "Comparative Molecular Modeling Study of Arabidopsis NADPH-Dependent Thioredoxin Reductase and Its Hybrid Protein." PLoS One 7(9), e46279 (2012.09) [ PDF ] (IF2011: 4.092).
    • 89. W. Jung, S. Kwon, M. Son, E. Cho, Y. Lee, J. Kim, B. Kim, D. Park, J. Hwang, T. Kim, H. Park, B. Park, J. Choi, K. Cho, K. Chung, Y. Song, I. Kim, S. Jin, D. Kim, S. Lee, K. W. Lee, W. Y. Bang, C. W. Kim, "RNA-Seq Approach for Genetic Improvement of Meat Quality in Pig and Evolutionary Insight into the Substrate Specificity of Animal Carbonyl Reductases." PLoS One 7(9), e42198 (2012.09) [ PDF ] (IF2011: 4.092).
    • 88. B. Lee, H. Lim, S. Kim, H. Youn, Y. Lee, Y. Kim, S. Eom, K. W. Lee, C. Park, "Localization of a Site of Action for Benzofuroindole-induced Potentiation of BK Channels." Molecular Pharmacology 82(2), 143-155 (2012.08) [ PDF ] (IF2011: 4.883).
    • 87. S. Sakkiah, S. Thangapandian, C. Park, M. Son, K. W. Lee, "Molecular Docking and Dynamics Simulation, Receptor-based Hypothesis: Application to Identify Novel Sirtuin 2 Inhibitors." Chemical Biology & Drug Design 80(2), 315-327 (2012.08) [ PDF ] (IF2011: 2.282).
    • 86. S. Thangapandian, S. John, P. Lazar, S. Choi, K. W. Lee, "Structural Origins for the Loss of Catalytic Activities of Bifunctional Human LTA4H Revealed through Molecular Dynamics Simulations." PLoS One 7(7), e41063 (2012.07) [ PDF ] (IF2011: 4.092).
    • 85. S. Sakkiah, M. Chandrasekaran, Y. Lee, S. Kim, K. W. Lee, "Molecular Modeling Study for Conformational Changes of Sirtuin2 due to Substrate and Inhibitor Binding." Journal of Biomolecular Structure & Dynamics 30(3), 235-254 (2012.07) [ PDF ] (IF2010: 4.986).
    • 84. S. Sakkiah, K. W. Lee, "Pharmacophore-based Virtual Screening and Density Functional Theory Studies to Identify Novel Butyrylcholinesterase Inhibitors." Acta Pharmacologica Sinica 33(7), 964-978 (2012.07) [ PDF ] (IF2011: 1.953).
    • 83. S. Sakkiah, S. Thangapandian, K. W. Lee, "Ligand-Based Virtual Screening and Molecular Docking Studies to Identify the Critical Chemical Features of Potent Cathepsin D Inhibitors." Chemical Biology & Drug Design 80(1), 64-80 (2012.07) [ PDF ] (IF2011: 2.282).
    • 82. S. Sakkiah, S. Thangapandian, K. W. Lee, "Pharmacophore Modeling, Molecular Docking, and Molecular Dynamics Simulation Approaches for Identifying New Lead Compounds for Inhibiting Aldose Reductase2." Journal of Molecular Modeling 18(7), 3267-3282 (2012.07) [ PDF ] (IF2011: 1.797).
    • 81. Amar A. Telke, Sunil S. Ghatge, S. H. Kang, S. Thangapandian, K. W. Lee, H. D. Shin, Y. Um, S. W. Kim, "Construction and Characterization of Chimeric Cellulases with Enhanced Catalytic Activity towards Insoluble Cellulosic Substrates." Bioresource Technology 112, 10-17 (2012.05) [ PDF ] (IF2011: 4.980).
    • 80. V. Arulalapperumal, S. Sakkiah, S. Thangapandian, Y. Lee, C. Meganathan, S. Hwang, K. W. Lee, "Ligand Based Pharmacophore Identification and Molecular Docking Studies for Grb2 Inhibitors." Bulletin of the Korean Chemical Society 33(5), 1707-1714 (2012.05) [ PDF ] (IF2011: 0.906).
    • 79. S. John, S. Thangapandian, K. W. Lee, "Potential Human Cholesterol Esterase Inhibitor Design: Benefits from the Molecular Dynamics Simulations and Pharmacophore Modeling Studies." Journal of Biomolecular Structure & Dynamics 29(5), 921-936 (2012.04) [ PDF ] (IF2010: 4.986).
    • 78. S. Sakkiah, C. Meganathan, Y. Sohn, S. Namadevan, K. W. Lee, "Identification of Important Chemical Features of 11¥â-Hydroxysteroid Dehydrogenase Type1 Inhibitors: Application of Ligand Based Virtual Screening and Density Functional Theory." International Journal of Molecular Sciences 13(4), 5138-5162 (2012.04) [ PDF ] (IF2011: 2.598).
    • 77. S. Thangapandian, S. John, M. Arooj, K. W. Lee, "Molecular Dynamics Simulation Study and Hybrid Pharmacophore Model Development in Human LTA4H Inhibitor Design." PLoS One 7(4), e34593 (2012.04) [ PDF ] (IF2011: 4.092).
    • 76. S. Sakkiah, A. Baek, K. W. Lee, "Pharmacophore Modeling and Molecular Dynamics Simulation to Identify the Critical Chemical Features against Human Sirtuin 2 Inhibitors." Journal of Molecular Structure 1011, 66-75 (2012.03) [ PDF ] (IF2011: 1.634).
    • 75. S. Sakkiah, S. Thangapandian, Y. Kim, K. W. Lee, "Pharmacophore Modeling and Molecular Dynamics Simulation to Find the Potent Leads for Aurora Kinase B¢Ó." Bulletin of the Korean Chemical Society 33(3), 869-880 (2012.03) [ PDF ] (IF2011: 0.906).
    • 74. S. Thangapandian, S. John, K. W. Lee, "Molecular Dynamics Simulation Study Explaining Inhibitor Selectivity in Different Class of Histone Deacetylases." Journal of Biomolecular Structure & Dynamics 29(4), 677-698 (2012.02) [ PDF ] (IF2010: 4.986).

    2011 (19 = 16 SCI + 1 KCI + 2 Domestic)

    • 73. Y. S. Lee, K. S. Ryu, Y. Lee, S. Kim, K. W. Lee, H. S. Won, "Oxidation-Induced Conformational Change of a Prokaryotic Molecular Chaperone, Hsp33, Monitored by Selective Isotope Labeling." Journal of the Korean Magnetic Resonance Society 15(1), 137-145 (2011.12) [PDF] (ÇÐÁøµîÀçÁö=KCI).
    • 72. S. Thangapandian, S. John, Y. Lee, S. Kim, K. W. Lee, "Dynamic Structure-Based Pharmacophore Model Development: A New and Effective Addition in the Histone Deacetylase 8 (HDAC8) Inhibitor Discovery." International Journal of Molecular Sciences 12(12), 9440-9462 (2011.12) [ PDF] (IF2010: 2.279).
    • 71. M. Arooj, S. Thangapandian, S. John, S. Hwang, J. K. Park, K. W. Lee, "3D QSAR Pharmacophore Modeling, in Silico Screening, and Density Functional Theory (DFT) Approaches for Identification of Human Chymase Inhibitors." International Journal of Molecular Sciences 12(12), 9236-9264 (2011.12) [ PDF] (IF2010: 2.279).
    • 70. S. John, S. Thangapandian, M. Arooj, J. C. Hong, K. D. Kim, K. W. Lee, "Development, Evaluation and Application of 3D QSAR Pharmacophore Model in the Discovery of Potential Human Renin Inhibitors." BMC Bioinformatics 12(Suppl 14):S4 (2011.12) [ PDF ] (IF2010: 3.029).
    • 69. S. Hwang, S. Thangapandian, Y. Lee, S. Sakkiah, S. John , K. W. Lee, "Discovery and Evaluation of Potential Sonic Hedgehog Signaling Pathway Inhibitors using Pharmacophore Modeling and Molecular Dynamics Simulations." Journal of Bioinformatics and Computational Biology 9(Suppl 1), 15-35 (2011.12) [ PDF ] (SCIE).
    • 68. S. Thangapandian, S. John, K. W. Lee, "Genetic Function Approximation and Bayesian Models for the Discovery of Future HDAC8 Inhibitors." Interdisciplinary Bio Central 3, article no. 15 (2011.11) [ PDF ] (Not SCI).
    • 67. P. Soundararajana, S. Sakkiahb, I. Sivanesanc, K. W. Lee*, B. R. Jeong*, "Macromolecular Docking Simulation to Identify Binding Site of FGB1 for Antifungal Compounds." Bulletin of The Korean Chemical Society 32(10), 3675-3681 (2011.10) [ PDF ] (IF2010: 0.871).
    • 66. M. Chandrasekaran, S. Sakkiah, K. W. Lee, "Combined Ligand Based Pharmacophore Modeling, Virtual Screening Methods to Identify Critical Chemical Features of Novel Potential Inhibitors for Phosphodiesterase-5." Journal of the Taiwan Institute of Chemical Engineers 42(5), 709-718 (2011.09) [ PDF ] (IF2010: 1.260).
    • 65. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Discovery of Potential Integrin VLA-4 Antagonists using Pharmacophore Modeling, Virtual Screening and Molecular Docking Studies." Chemical Biology & Drug Design 78(2), 289-300 (2011.08) [ PDF ] (IF2010: 2.527).
    • 64. S. John, S. Thangapandian, S. Sakkiah, K. W. Lee, "Discovery of Potential Pancreatic Cholesterol Esterase Inhibitors Using Pharmacophore Modeling, Virtual Screening and Optimization Studies." Journal of Enzyme Inhibition and Medicinal Chemistry 26(4), 535-545 (2011.08) [ PDF ] (IF2010: 1.574).
    • 63. S. Kim, Y. Lee, P. Lazar, M. Son, A. Baek, S. Thangapandian, N. Y. Jeong, Y. H. You, K. W. Lee, "Binding Conformation Prediction between Human Acetylcholinesterase and Cytochrome c using Molecular Modeling Methods." Journal of Molecular Graphics and Modeling 29(8), 996-1005 (2011.08) [ PDF ] [ Selected as Top 25 Hottest Articles ] (IF2010: 2.038).
    • 62. S. Sakkiah, S. Thangapandian, S. John, K. W. Lee, "Pharmacophore Based Virtual Screening, Molecular Docking Studies to Design Potent Heat Shock Protein 90 Inhibitors." European Journal of Medicinal Chemistry 46(7), 2937-2947 (2011.07) [ PDF ] [ Selected as Top 25 Hottest Articles (1st Ranked) ] (IF2010: 3.193).
    • 61. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Potential Virtual Lead Identification in the Discovery of Renin Inhibitors: Application of Ligand and Structure-Based Pharmacophore Modeling Approaches." European Journal of Medicinal Chemistry 46(6), 2469-2476 (2011.06) [ PDF ] (IF2010: 3.193).
    • 60. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Pharmacophore-based virtual screening and Bayesianmodel for the identification of potential human leukotriene A4 hydrolase inhibitors." European Journal of Medicinal Chemistry 46(5), 1593-1603 (2011.05) [ PDF ] (IF2010: 3.193).
    • 59. S. John, S. Thangapandian, S. Sakkiah, K. W. Lee, "Potent BACE-1 Inhibitor Design using Pharmacophore Modeling, In Silico Screening and Molecular Docking Studies." BMC Bioinformatics 12(Suppl 1):S28 (2011.02)[ PDF ] (IF2010: 3.029).
    • 58. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Molecular Modeling Study on Human Histamine H1 Receptor and Its Applications in Virtual Lead Identification for Designing Novel Inverse Agonists." Molecular Simulation 37(2), 100-114 (2011.02) [ PDF ] (IF2010: 1.215).
    • 57. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Molecular Docking and Pharmacophore Filtering in The Discovery of Dual-Inhibitors for Human Leukotriene A4 Hydrolase and Leukotriene C4 Synthase." Journal of Chemical Information and Modeling 51(1), 33-44 (2011.01) [ PDF ] (IF2010: 3.822).
    • 56. Y. Sohn, Y. Lee, C. Park, S. Hwang, S. Kim, A. Baek, M. Son, J-K. Suh, H-H. Kim, K. W. Lee, "Pharmacophore Identification for Peroxisome Proliferater-Activated Receptor gamma Agonists." Bulletin of the Korean Chemical Society 32(1), 201 - 207 (2011.01) [ PDF ] (IF2010: 0.871).
    • 55. S. Sakkiah, S. Thangapandian, S. John, K. W. Lee, "Identification of critical chemical features for Aurora kinase-B inhibitors using Hip-Hop, virtual screening and molecular docking." Journal of Molecular Structure 985(1), 14-26 (2011.01) [ PDF ] [ Selected as Top 25 Hottest Articles (4th Ranked) ] (IF2010: 1.599).

    2010 ( 15 SCI + 2 Patent Registrations)

    • International (US) Patent: A. Volkov, C. Colbert, I. Pan, A. Kraltcheva, M. Reddy, N. Battulga, M. Rea, K. W. Lee, B. Mulder, S. Hardin "Method for Analyzing Dynamic Detectable Events at the Single Molecular Level." US Patent No. US7668697 (23-Feb-2010) [ PDF ]
    • International (US) Patent: S. A. Martinis, J. M. Briggs, R. S. Mursinna, K. W. Lee, T. L. Lincecum, C. Davis, M. Cui, A. M. Williams, J. A. Speidel, Y. Zhai "Method and Composition for Leucyl-tRNA Synthetases and Derivatives thereof That Activate and Aminoacylate Non-Leucine Amino Acids to tRNA Adaptor Molecules." US Patent No. US7785827 (31-Aug-2010) [ PDF ]
    • 54. P. Lazar, Y. Lee, S. Kim, K. W. Lee, "Computational approach to ensure the stability of the favorable ATP binding site in E.coli Hfq." Journal of Molecular Graphics and Modeling 29(4), 573-580 (2010.12) [ PDF ] (IF2009: 2.169).
    • 53. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Docking-Enabled Pharmacophore Model for Histone Deacetylase 8 Inhibitors and Its Application in Anti-Cancer Drug Discovery." Journal of Molecular Graphics and Modeling 29(3), 382-395 (2010.11) [ PDF ] (IF2009: 2.169).
    • 52. M. Chandrasekaran, S. Shakkiah, S. Thangapandian, S. Namadevan, H.-H. Kim, Y. Kim, K. W. Lee, "Pharmacophore Design for Anti-inflammatory Agent Targeting Interleukin-2 Inducible Tyrosine Kinase (Itk)." Bull. Korean Chem. Soc. 31(11), 3333 - 3340 (2010.11) [ PDF ] (IF2009: 0.936).
    • 51. M. Chandrasekaran, S. Sebastian, M. Kurt, K. W. Lee, N. Sundaraganesan, "Molecular Structure, Spectroscopic (FTIR, FTIR gas phase, FT-Raman) first order hyperpolarizability and HOMO-LUMO analysis of 4-methoxy-2-methyl benzoic acid." Journal of Raman Spectroscopy 41, 1369-1378 (2010.11) [ PDF ] (IF: 3.526).
    • 50. J. Y. Kim, J. W. Lee, Y. S. Kim, Y. B. Ryu, S. Kim, H. W. Ryu, M. J. Curtis-Long, K. W. Lee, W. S. Lee, K. H. Park, "A Novel Competitive Class of a-Glucosidase Inhibitors: (E)-1-Phenyl-3-(4-Stryrylphenyl)Urea Derivatives." ChemBioChem 11(15), 2125-2131 (2010.10) [ PDF ] (IF2009: 3.824).
    • 49. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Ligand and Structure Based Pharmacophore Modeling to Facilitate Novel Histone Deacetylase 8 Inhibitor Design." European Journal of Medicinal Chemistry 45(10), 4409-4417 (2010.10) [ PDF ] [ Selected as Top 25 Hottest Articles ] (IF2009: 3.269).
    • 48. Y. Lee, W. Y. Bang, S. Kim, P. Lazar, C. W. Kim, J. D. Bahk, K. W. Lee, "Molecular Modeling Study for Interaction between Bacillus subtilis Obg and Nucleotides." PLoS ONE 5(9), e12597 (2010.09) [ PDF ] (IF2009: 4.351).
    • 47. S. John, S. Thangapandian, S. Sakkiah, K. W. Lee, "Identification of Potent Virtual Leads to Design Novel Indoleamine 2,3-Dioxygenase Inhibitors: Pharmacophore Modeling and Molecular Docking Studies." European Journal of Medicinal Chemistry 45(9), 4004-4012 (2010. 09) [ PDF ] [ Selected as Top 25 Hottest Articles ] (IF2009: 3.269).
    • 46. P. Lazar, Y. Lee, S. Kim, M. Chandrasekaran, K. W. Lee, "Molecular Dynamics Simulation Study for Ionic Strength Dependence of RNA-host factor Interaction in Staphylococcus aureus Hfq" Bull. Korean Chem. Soc. 31(6), 1519 - 1526 (2010.06) [ PDF ] (IF2009: 0.936).
    • 45. S. Sakkiah,S. Thangapandian, S. John, Y. J. Kwon, K. W. Lee, "3D QSAR Pharmacophore Based Virtual Screening and Molecular Docking for Identification of Potential HSP90 Inhibitors." European Journal of Medicinal Chemistry 45, 2132-2140 (2010.06) [ PDF ] [ Selected as Top 25 Hottest Articles ] (IF: 3.269).
    • 44. N. Krishnamoorthy, P. Gajendrarao, S. Thangapandian, Y. Lee, K. W. Lee, "Probing Possible Egress Channels for Multiple Ligands in Human CYP3A4: A Molecular Modeling Study." Journal of Molecular Modeling 16, 607-614 (2010.04) [ PDF ] (IF: 2.336).
    • 43. H. Eum, Y. Lee, S. Kim, A. Baek, M. Son, K. W. Lee, S. W. Ko, S. Kim, S. Y. Yun,. W. K. Lee, and H.-J. Ha, "Synthesis of Substituted Imidazolidin-2-ones as Aminoacyl-tRNA Synthase Inhibitors." Bull. Korean Chem. Soc. 31(3), 611-614 (2010.03) [ PDF ] (IF: 0.936).
    • 42. N. Bharatham, K. Bharatham, Y. Lee, S. Kim, P. Lazar, A. Baek, C. Park, H. Eum, H.-J. Ha, S. Y. Yun, W. K. Lee, S. Kim, K. W. Lee, "Molecular Docking Study of Aminoacyl-tRNA Synthetases (aaRSs) with Ligand Molecules from Four Different Scaffolds." Bull. Korean Chem. Soc. 31(3), 606-610 (2010.03) [ PDF ] (IF: 0.936).
    • 41. P. Gajendrarao, N. Krishnamoorthy, S. Sakkiah, K. W. Lee, "Molecular Modeling Study on the Orphan Human Protein CYP4A22 for Identification of Potential Ligand Binding Sites." Journal of Molecular Graphics and Modeling 28, 524-532 (2010.02) [ PDF ] (IF: 2.169).
    • 40. S. Thangapandian, N. Krishnamoorthy, S. John, S. Sakkiah, P. Lazar, Y. Lee, K. W. Lee, "Pharmacophore Modeling, Virtual Screening and Molecular Docking Studies for Identification of New Inverse Agonists of Human Histamine H1 Receptor." Bull. Korean Chem. Soc. 31(1), 52-58 (2010.01). [ PDF ] (IF: 0.936).

    2009 (5 SCI + 1 domestic)

    • 39. P. Lazar, S. Kim, Y. Lee, M. Son, H.-H. Kim, Y. S. Kim, K. W. Lee, "Molecular Modeling Study on the Effect of Residues Distant from the Nucleotide Binding Portion on RNA Binding in Staphylococcus aureus Hfq." Journal of Molecular Graphics and Modeling 28, 253-260 (2009.10) [ PDF ] (IF: 2.169).
    • 38. Woo Young Bang, Akira Hata, In Sil Jeong, Tetsuya Umeda, Takayuki Masuda, Ji Chen, Ishizaki Yoko, I Nengah Suwastika, Dae Won Kim, Chak Han Im, Byung Hyun Lee, Yuno Lee, Keun Woo Lee, Takashi Shiina and Jeong Dong Bahk, "AtObgC, a plant ortholog of bacterial Obg, is a chloroplast-targeting GTPase essential for early embryogenesis." Plant Molecular Biology 71 379-390 (2009.07) [ PDF ] (IF: 3.541).
    • 37. N. Bharatham, K. Bharatham, Y. Lee, K. W. Lee, "Molecular Dynamics Simulation Study of Valyl-tRNA Synthetase with its Pre- and Post-transfer Editing Substrates." Biophysical Chemistry 143 (1-2) 34-43 (2009.07) [ PDF ] (IF:1.913).
    • 36. S. Sakkiah, N. Krishnamoorthy, P. Gajendrarao, S. Thangapandian, Y. Lee, S. Kim, J.-K. Suh, H.-H. Kim, K. W. Lee, "Pharmacophore Mapping and Virtual Screening for SIRT1 Activators." Bull. Korean Chem. Soc. 30(5) 1152-1156 (2009.05). [ PDF ] (IF: 1.257).
    • 35. Y. Lee, W. Bang, S. Kim, P. Lazar, J. D. Bahk, K. W. Lee, "Binding Mode Analysis of Bacillus subtilis Obg with Ribosomal Protein L13 through Computational Docking Study." Interdisciplinary Bio Central DOI:10.4051/ibc.2009.1.0003 (2009.03) [ PDF ] [ WWW ] (IF: Not SCI).
    • 34. Y. S. Kang, S. Y. Park, C. H. Yim, H. S. Kwak, P. Gajendrarao, N. Krishnamoorthy, H. Yoon, K. W. Lee, K.O. Han "CYP3A4*18 Genotype in Cytochrome P450 3A4 Gene, a Rapid Metabolizer of Sex Steroids, is Associated with Low Bone Mineral Density." Clinical Pharmacology and Therapeutics 85(3) 312-318 (2009.03) [ PDF ] (IF: 7.586).

    2008 (4 SCI)

    • 33. Y. B. Ryu, M. J. Curtis-Long, J. H. Kim, S. H. Jeong, M. S. Yang, W. S. Lee, K. W. Lee, K. H. Park "Pterocarpans and Flavanones from Sophora Flavescens Displaying Potent Neuraminidase Inhibition." Bioorganic & Medicinal Chemistry Letters 18 6046-6049 (2008.12) [ PDF ] (IF:2.604).
    • 32. K. Bharatham, N. Bharatham, Y. J. Kwon, K. W. Lee, "Molecular Dynamics Simulation Study of PTP1B with Allosteric Inhibitor and its Application in Receptor Based Pharmacophore Modeling." Journal of Computer-Aided Molecular Design 22 925-933 (2008.12) [ PDF ] (IF:3.620).
    • 31. N. Krishnamoorthy, P. Gajendrarao, S. H. Eom, Y. J. Kwon, G. Cheong, K. W. Lee, "Molecular Modeling Study of CodX Reveals Importance of N-terminal and C-terminal Domain in the CodWX Complex Structure of Bacillus subtilis." Journal of Molecular Graphics and Modelling 27 1-12 (2008.08) [ PDF ] (IF: 2.347).
    • 30. K. Bharatham, N. Bharatham, K. H. Park, K. W. Lee, "Binding Mode Analyses and Pharmacophore Model Development for Sulfonamide Chalcone Derivatives, a New Class of a-Glucosidase Inhibitors." Journal of Molecular Graphics and Modelling 26 1202-1212 (2008.05) [ PDF ] (IF: 2.347). (This article was selected as the 2nd hottest article from the all JMGM articles for April to June 2008: PDF )

    2007 (6 SCI)

    • 29. K. Bharatham, N. Bharatham, K. W. Lee, "Pharmacophore Modeling for Protein Tyrosine Phosphatase 1B Inhibitors." Archives of Pharmacal Research 30(5) 533-542 (2007.05) [ PDF ] (IF: 1.074).
    • 28. Y. Lee, N. Bharatham, K. Bharatham, K. W. Lee, "Adenosine Kinase Inhibitor Design Based on Pharmacophore Modeling." Bull. Korean Chem. Soc. 28(4) 561-566 (2007.04). [ PDF ] (IF: 1.257).
    • 27. Y. Zhai, M. H. Nawaz, E. Kirkbride, K. W. Lee, J. M. Briggs, S. A. Martinis "Modulation of Substrate Specificity within the Amino Acid Editing Site of Leucyl-tRNA Synthetase." Biochemistry 46(11), 3331-3337 (2007.03). [ PDF ] (IF: 3.379)
    • 26. N. Bharatham, K. Bharatham, K. W. Lee, "Pharmacophore Identification and Virtual Screening for Methionyl-tRNA Synthetase inhibitors." Journal of Molecular Graphics and Modelling 25(6) 813-823 (2007.03) [ PDF ] (IF: 2.347).
    • 25. K. W. Lee, Y. J. Kwon, J. M. Briggs, "Three Common Subunits in Editing Domains of Class Ia tRNA Synthetases." Bull. Korean Chem. Soc. 28(2) 207-210 (2007.02). [ PDF ] (IF: 1.257)
    • 24. N. Bharatham, K. Bharatham, K. W. Lee, "P56 LCK Inhibitor Identification by Pharmacophore Modelling and Molecular Docking." Bull. Korean Chem. Soc. 28(2) 200-206 (2007.02). [ PDF ] (IF: 1.257).

    2006 (6 = 1 SCI + 5 domestic )

    • 23. ±èÁø½Ä, À̱ٿì, Áø¿ë¼ö, À¯¼®Á¾, Á¤±Ô¿­, ÀÌÁø¿ø, ÀÌ»ó¿±, Ȳ´ëÈñ, "´ë»ç°æ·Î Ç¥ÁØÈ­ ÇöȲ (Standardization on Metabolic and Biological Pathway)." Bioinformatics and Biosystems 1(4) 196-200 (2006.12). [ HWP ]
    • 22. ±èº´¿ì, À̱ٿì, ±èÈ¿¼±, ³ë½ÂÈñ, ¹ÚÁؼø, ÀÌÀ±È£, ÀüÁøÅÂ, ±ÇÀºÁ¤, ±èö¿í, ÀÌÁ¤±Ô, "TIGR Gene Indices¸¦ ÀÌ¿ëÇÑ µÅÁö cDNA Chip Á¦ÀÛ¿ë Èĺ¸À¯ÀüÀÚ ¿°±â¼­¿­ È®º¸ ¹æ¾È" Bioinformatics and Biosystems 1(3) 174-180 (2006.09). [ PDF ]
    • 21. L. Shui, N. Bharatham, K. Bharatham, K. W. Lee, "Urokinase Inhibitor Design Based on Pharmacophore Model Derived from Diverse Classes of Inhibitors." Bioinformatics and Biosystems 1(2) 115-122 (2006.06). [ PDF ]
    • 20. ±èº´¿ì, À̱ٿì, ±èÈ¿¼±, ³ë½ÂÈñ, ÀÌÀ±È£, ±è½Ãµ¿, ÀüÁøÅÂ, ÀÌÁö¿õ, Á¶¿ë¹Î, Á¤ÀÏÁ¤, ÀÌÁ¤±Ô, "»ý¹°Á¤º¸½Ã½ºÅÛÀ» ÀÌ¿ëÇÑ Local Animal BLAST Search System ±¸Ãà." Bioinformatics and Biosystems 1(2) 99-102 (2006.06). [ PDF ]
    • 19. À̱ٿì, "°è»ê»ý¹°ÇÐÀ» ÀÌ¿ëÇÑ AIDSÄ¡·áÁ¦ °³¹ß" È­Çм¼°è 2006-05, 38-45 (2006.05). [ PDF ]
    • 18. N. Bharatham, K. Bharatham, K. W. Lee, "Quantitative Structure-Activity Relationships (QSAR) and Molecular Docking Studies of P56 LCK Inhibitors." Bull. Korean Chem. Soc. 27(2) 266-272 (2006.02). [ PDF ] (IF: 1.257)

    2005 (5 SCI)

    • 17. S. B. Rho, K. W. Lee, S.-H. Lee, K. Park, J.-H. Lee "The Identification of Apotosis-Related Residues in Human Thymosin ¥â-10 by Mutational Analysis and Computational Modeling." J. Biol. Chem. 280(30) 34003-34007 (2005.10). (Co-First Authors) [ PDF ] (IF: 5.520)
    • 16. B. A. Mulder, P. Yu, S. Anaya, K. W. Lee, A. Nguyen, J. Murphy, R. Willson, J. M. Briggs, X. Gao, S. H. Hardin "Nucleotide Modification at the ¥ã-phosphate Leads to the Improved Fidelity of HIV-1 Reverse Transcriptase." Nucleic Acids Res. 33(15) 4865-4873 (2005.09). [ PDF ] (IF: 6.878)
    • 15. A. Brigo, K. W. Lee, F. Fogolari, G. I. Mustata, J. M. Briggs "Comparative Molecular Dynamics Simulations of HIV-1 Integrase and the T66I/M154I Mutant: Binding Modes and Drug Resistance to a Diketo Acid Inhibitor." PROTEINS: Structure, Function and Bioinformatics 59(4), 723-741 (2005.06). [ PDF ] (IF: 3.419)
    • 14. A. Brigo, K. W. Lee, G. I. Mustata, J. M. Briggs "Comparison of Multiple Molecular Dynamics Trajectories Calculated for the Drug-Resistant HIV-1 Integrase T66I/M154I Catalytic Domain." Biophysical J. 88(5), 3072-3082 (2005.05). [ PDF ] (IF: 4.683)
    • 13. J. Deng, K. W. Lee, T. Sanchez, M. Cui, N. Neamati, J. M. Briggs "Dynamic Receptor-Based Pharmacophore Model Development and its Application in Designing Novel HIV-1 Integrase Inhibitors." J. Med. Chem. 48(5), 1496-1505 (2005.03). [ PDF ] (IF: 4.898)

    2004 (4 = 3 SCI + 1 )

    • 12. À̱ٿì "°è»ê»ý¹°ÇÐÀÇ ¼Ò°³." Korean. Biophys. Soc. Newsletter 10(1), 10-22 (2004.12). [ PDF ]
    • 11. K. W. Lee , J. M. Briggs " Molecular Modeling Study of the Editing Activity of E. coli Leucyl-tRNA Synthetase: Two Amino Acid Binding Sites in the Editing Domain." PROTEINS: Structure, Function and Bioinformatics 54(4) 693-704 (2004.03). [ PDF ] (IF: 3.419)
    • 9. R. S. Mursinna, K. W. Lee, J. M. Briggs, S. A. Martinis "Molecular Dissection of a Critical Specificity Determinant within the Amino Acid Editing Domain of Leucyl-tRNA Synthetase." Biochemistry 43(1), 155-165 (2004.01). [ PDF ] (IF: 3.379) (Co-First Authors)

    Up to 2003 (8 = 7 SCI + 1 )

    • 8. M. L. Barreca, K. W. Lee , A. Chimirri, J. M. Briggs "Molecular Dynamics Studies of the Wild-type and Double Mutant HIV-1 Integrase Complexed with the 5CITEP Inhibitor: Mechanism for Inhibition and Drug Resistance." Biophysical J. 84(3), 1450-1463 (2003.03). [ PDF ] (IF: 4.757 / 4.627)
    • 7. K. W. Lee, J. M. Briggs "Comparative Molecular Field Analysis (CoMFA) Study of Epothilones- Tubulin Depolymerization Inhibitors: Pharmacophore Development Using 3D QSAR Methods." J. Computer-Aided Molecular Design 15(1), 41-55 (2001.01). [ PDF ] (IF: 3.620)
    • 6. N. Liu, H. Samartzidou, K. W. Lee, J. M. Briggs, A. Delcour "Effects of Pore Mutations and Permeant Ion Concentration on the Spontaneaous Gating Action of OmpC Porin." Protein Engineering Design and Selection 13(7), 491-500 (2000.01). [ PDF ] (IF: 2.787)
    • 5. K. W. Lee ,S. Y. Kwon, S. Hwang, J.-U. Lee, H. Kim "Quantitative Structure-Activity Relationship (QSAR) Study on C-7 Substituted Quinolone." Bull. Korean Chem. Soc. 17(2), 147-152 (1996.02) [ PDF ] (IF: 1.257)
    • 4. K. W. Lee , H. Kim "Quantitative Structure-Activity Relationship(QSAR) Study by Use of Theoretical Descriptors: Quinolone and Naphthyridine." Bull. Korean Chem. Soc. 15(12), 1070-1079 (1994.12).  [ PDF ] (IF: 1.257)
    • 3. J. H. Lee, K. W. Lee, H. Kim "A Study on Ni-H, Pd-H, and Pt-H Systems by Cluster Orbital Method." Bull. Korean Chem. Soc. 14(2), 225-234 (1993.02). [ PDF] (IF: 1.257)
    • 2. K. W. Lee , H. Kim "Quantitative Structure-Activity Relationship Study on Quinolones and Naphthyridines." Kor. J. of Med. Chem. 2(2), 113-121 (1992.10). [ PDF ]
    • 1. K. W. Lee , H. Kim  "The Hydrogen Atom in Interstices of Pd Cluster." Bull. Korean Chem. Soc. 13(4), 367-375 (1992.04). [ PDF ] (IF: 1.257)




    3. Poster Presentations/ ÇмúȸÀǹßÇ¥: ÃÑ 200+ °Ç

    2018


    [AsiaTIDES 2018: Oligonucleotide and Peptide Therapeutics]

    • 206. C. Park, M. Son, K. W. Lee, "." AsiaTIDES 2018: Oligonucleotide and Peptide Therapeutics, Westin Miyako Kyoto, Kyoto, Japan, Feb.27-Mar.1, 2018.
    • 205. , "Molecular modeling approaches to design peptide inhibitors for botulinum neurotoxin A." AsiaTIDES 2018: Oligonucleotide and Peptide Therapeutics, Westin Miyako Kyoto, Kyoto, Japan, Feb.27-Mar.1, 2018.

    2017


    [GIW/BIOINFO 2017 Annual Conference]

    • 204. P. Shraddha, R. Shailima, K. W. Lee, "Investigation of Protein Stability in Water Droplet on a Glass Surface by Molecular Dynamics Simulation." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.
    • 203. P. Saravanan, R. Shailima, R. Kumar, K. W. Lee, "Structure Based Drug Design of FadD32 Inhibitors to Combat Tuberculosis." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.
    • 202. R. Kumar, P. Saravanan, K. W. Lee, "Exploration of Potential Leads against Human Tryptophan 2, 3-Dioxygenase using Computational Molecular Designing Approaches." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.
    • 201. M. Rabia, A. Baek, R. Shailima, K. W. Lee, "Computational Approach to Analyze Binding Mode of Tryptophan on Au (111) Surface." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.
    • 200. R. Shailima, M. Son, A. Beak, R. Kumar, P. Saravanan, Z. Amir, K. W. Lee, "Discovery of Potential Inhibitors Targeting HER2 against Breast Cancer." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.
    • 199. G. Lee, C. Park, M. Son, A. Beak, K. W. Lee, "Computational Protein Engineering Study for Improving Enzyme Activity of Clostridium hylemonae D-Psicose 3-Epimerase." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.
    • 198. D. Kim, M. Son, C. Park, K. W. Lee, "In silico Approach in Protein Redesign to Improve Thermostability of Lactobacillus reuteri Mannitol 2-Dehydrogenase Enzyme." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.
    • 197. Y. Cho, C. Park, Z. Amir, P. Saravanan, R. Shailima, K. W. Lee, "Improvement of Growth Rate of Bacillus subtilis through Inhibition of S-Ribosylhomocysteinelyase Related with Quorum Sensing." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.
    • 196. Z. Amir, C. Park, M. Son, Y. Cho, R. Shailima, D. Kim, K. W. Lee, "Integration of Virtual Screening and Computational Simulation Identifies Photodynamic Therapeutics against Human Protophorphyrinogen Oxidase IX." BIOINFO 2017 GIW/BIOINFO Annual Conference, Samjung Hotel, Seoul, Korea, Oct. 31 - Nov. 3, 2017.

    2016


    [BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ]

    • 195. D. Kim, G. Lee, Y. Choi, Y. Cho, C. Park, M. Son, A. Baek, R. Kumar, R. Shailima, Z. Amir, K. W. Lee, "GNU DR i-Server Development for Drug Repositioning: Part ¥³. Application for Viagra and Megesterol Acetate." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.
    • 194. Y. Cho, Y. Choi, G. Lee, D. Kim, C. Park, M. Son, A. Baek, R. Kumar, R. Shailima, Z. Amir, K. W. Lee, "GNU DR i-Server Development for Drug Repositioning: Part ¥². To Build Docking Plaza." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.
    • 193. G. Lee, Y. Cho, Y. Choi, D. Kim, C. Park, M. Son, A. Baek, R. Kumar, R. Shailima, Z. Amir, K. W. Lee, "GNU DR i-Server Development for Drug Repositioning: Part ¥±. To Build Target Protein Database." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.
    • 192. Y. Choi, G. Lee, D. Kim, C. Park, M. Son, A. Baek, R. Kumar, R. Shailima, Z. Amir, K. W. Lee, "GNU DR i-Server Development for Drug Repositioning: Part ¥°. To Build R-Drug Database." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.
    • 191. R. kumar, R. Bavi, A. Baek, R. Shailima, K. W. Lee, "Comparative Modeling of Tetrameric Form of Human Tryptophan 2,3-Dioxygenase (TDO) and Optimization of the Active Site for Structure-Based Drug Design." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.
    • 190. R. Shailima, R. kumar, M. Son, C. Park, A. Baek, K. W. Lee, "High Throughput Virtual Screening Coupled with Density Functional Theory to Establish Aromatase Inhibitors as Antiepileptic Drugs." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.
    • 189. Z. Amir, C. Park, M. Son, I. Alam, K. W. Lee, "In silico Identification of Novel Chemical Scaffolds for Domain Selective Inhibition of HDAC6." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.
    • 188. D. Kim, M. Son, C. Park, K. W. Lee, "3D Structure Prediction of Human Aryl Hydrocarbon Receptor (AHR) using Homology Modeling Approach." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.
    • 187. A. Beak, M. Son, K. W. Lee, "Identification of Feedback-Resistant Streptococcus pneumonia Mevalonate Kinase (SpMVK) by in silico Mutagenesis." BIOINFO 2016 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Á¤±âÇмú´ëȸ, Incheon Global Campus, Incheon, Korea, Aug. 17-19, 2016.

    2015


    [BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ]

    • 186. Y. Choi, M. Son, K. W. Lee, "Computer-Aided Drug Designing for NFAT Selective Inhibition in Calcineurin Pathway." BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Seoul National University, Seoul, Korea, Oct. 21-23, 2015.
    • 185. M. Son, C. Park, W. Y. Bang, K. W. Lee, "Novel Natural Compound Inhibitor Finding against ¥â-Secretase (BACE1) using Computer-Aided Drug Discovery Approaches ." BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Seoul National University, Seoul, Korea, Oct. 21-23, 2015.
    • 184. L. Choi, C. Park, K. W. Lee, "In silico Molecular Docking Study on Binding Conformation for the Natural Products Binding to Pathogenesis-Related 10-3 Protein of Panax ginseng." BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Seoul National University, Seoul, Korea, Oct. 21-23, 2015.
    • 183. R. Kumar, R. Bavi, V. Arulalapperumal, K. W. Lee, "Novel Prolyl Oligopeptidase (POP) Inhibitor Identification Via Computational Molecular Designing Approaches." BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Seoul National University, Seoul, Korea, Oct. 21-23, 2015.
    • 182. I. Alam, R. Bavi, M. Son, A. Bashir, R. Kumar, C. Park, G. Cao, K. W. Lee, "Identification of Novel Non-¥â-Lactam Inhibitors for AmpC ¥â-Lactamases by Computational Drug Design Approaches." BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Seoul National University, Seoul, Korea, Oct. 21-23, 2015.
    • 181. G. Lee, C. Park, K. W. Lee, "Computational Protein Engineering Study for Improving and Changing Enzyme Activity of Clostridium hylemonae D-Psicose 3-Epimerase." BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Seoul National University, Seoul, Korea, Oct. 21-23, 2015.
    • 180. A. Baek, K. W. Lee, "In silico Approach for Prediction of Feedback-Resistant Streptococcus pneumonia Mevalonate Kinase(SpMVK)." BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Seoul National University, Seoul, Korea, Oct. 21-23, 2015.
    • 179. A. Bashir, Y. Lee, M. Son, R. Kumar, G. Cao, I. Alam, K. W. Lee, "Human Acetyl CoA Carboxylase2 (ACC2) Inhibitor Designing for Finding Anti-Cholesterol Agent." BIOINFO 2015 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Seoul National University, Seoul, Korea, Oct. 21-23, 2015.

    [IBC's 7th Annual AsiaTIDES (Oligonucleotide and Peptide)]

    • 178. C. Park, M. Son, K. W. Lee, "Molecular modeling approaches to design peptide inhibitors for botulinum neurotoxin A." IBC's 7th Annual AsiaTIDES (Oligonucleotide and Peptide), Hyatt Regency Osaka, Osaka, Japan, Mar. 3-5, 2015.

    2014


    [BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ]

    • 177. G. P. Cao, K. W. Lee, "Neighborhood Classifier (NEC) Based QSAR Study for Discovery of Histone Deacetylase 8 Inhibitors." BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Yonsei University, Seoul, Korea, Nov. 12-14, 2014.
    • 176. G. Lee, C. Park, M. Son, K. W. Lee, "Computational Protein Engineering Study for Improvement of the Enzyme Activity for Clostridium hylemonae D-Psicose 3-Epimerase." BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Yonsei University, Seoul, Korea, Nov. 12-14, 2014.
    • 175. M. Son, C. Park, K. W. Lee, "Pharmacophore and Molecular Modeling Studies to Identify Novel Candidates for Acetylcholinesterase Inhibitors." BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Yonsei University, Seoul, Korea, Nov. 12-14, 2014.
    • 174. V. Arulalapperumal, C. Park, M. Son, A. Baek, R. Kumar, R. S. Bavi, K. W. Lee, "Identification of Functionally Important Genes of Epithelial Cells Treated with TGF-¥â Induced Epithelial Mesenchymal Transition Modele." BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Yonsei University, Seoul, Korea, Nov. 12-14, 2014.
    • 173. A. Baek, K. W. Lee, "In silico Approach for Characterization of Feedback-Resistant Mevalonate Kinase from Streptococcus pneumoniae." BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Yonsei University, Seoul, Korea, Nov. 12-14, 2014.
    • 172. C. Park, M. Son, K. W. Lee, "Discovery of Trypanosomatid-Selective Inhibitors of Glyceraldehyde-3-Phosphate Dehydrogenase by Computational Structure-Based Drug Design." BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Yonsei University, Seoul, Korea, Nov. 12-14, 2014.
    • 171. R. S. Bavi, A. Baek, R. Kumar, C. Park, K. W. Lee, "Molecular Modeling Studies of Nucleotide Excision Repair UvrB Protein from Helicobacter Pylori." BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Yonsei University, Seoul, Korea, Nov. 12-14, 2014.
    • 170. R. Kumar, M. son, Y. Lee, R. S. Bavi, C. Park, V. Arulalapperumal, K. W. Lee, "Development of 3D QSAR Pharmacophore Model for Designing Lead Candidates of AKR1B10 Inhibitors." BIOINFO 2014 Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ»ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Yonsei University, Seoul, Korea, Nov. 12-14, 2014.

    [The 3rd International GNU Symposium on Agrobiotechnology 2014]

    • 169. A. Bashir, M. Son, V. Arulalapperumal, R. Kumar, K. W. Lee, "Identification of potent inhibitors for carboxyl transferase (CT) domain of human acetyl CoA carboxylase1 (ACC1) by pharmacophore modeling and molecular docking." The 3rd International GNU Symposium on Agrobiotechnology 2014, Gyeonsang National University, Jinju, Korea, Sep. 21-23, 2014.
    • 168. R. Kumar, M. Son, Y. Lee, R. S. Bavi, C. Park, V. Arulalapperumal, K. W. Lee, "Ligand-based pharmacophore modeling and supplementary approaches to identify AKR1B10 inhibitor." The 3rd International GNU Symposium on Agrobiotechnology 2014, Gyeonsang National University, Jinju, Korea, Sep. 21-23, 2014.
    • 167. G. Lee, C. Park, K. W. Lee, "Prediction of Functionally Important Genes for Target Identification of Lung Cancer Disease and Pharmacophore Modeling and Molecular Docking for PEP Inhibitor." The 3rd International GNU Symposium on Agrobiotechnology 2014, Gyeonsang National University, Jinju, Korea, Sep. 21-23, 2014.

    [The 4th Asia Pacific Protein Association (APPA) Conference]

    • 166. K. W. Lee, M. Arooj, G. P. Cao, V. Arulalapperumal, "Computer-Aided Drug Design (CADD) for Human Chymase via Systems Biology." The 4th Asia Pacific Protein Association (APPA) Conference, ICC Jeju, Korea, May. 17-20, 2014. [Oral Presentation]

    [9th Annual Great Lakes Bioinformatics Conference]

    • 165. V. Arulalapperumal, S. Thangapandian, S. John, S. Kim, M. Arooj, S. Sakkiah, Y. Lee, G. P. Cao, K. W. Lee, "Prediction of Functionally Important Genes for Target Identification of Lung Cancer Disease and Pharmacophore Modeling and Molecular Docking for PEP Inhibitor." 9th Annual Great Lakes Bioinformatics Conference, Cincinnati Children's Hospital Medical Center, Cincinnati, Ohio, America, May. 16-18, 2014. [Oral Presentation]
    • 164. V. Arulalapperumal, S. Sakkiah, S. John, Y. Lee, M. Arooj, K. W. Lee, "Pathway Comparision and Target Identification of Clucocorticoid Receptor Activation Effect (GRAE) on Human Cancer Cells by Differential Cene Expression Analysis and Survival Analysis." 9th Annual Great Lakes Bioinformatics Conference, Cincinnati Children's Hospital Medical Center, Cincinnati, Ohio, America, May. 16-18, 2014.

    [IBC's 6th Annual AsiaTIDES (Oligonucleotide and Peptide)]

    • 163. V. Arulalapperumal, C. Park, N. Devi, M.Son, A. Baek, K. W. Lee, "Identifying Drug Target and Off-Targets of Human Alzheimer Disease by Chemical Compound Mining and Systems Biology Approaches." IBC's 6th Annual AsiaTIDES (Oligonucleotide and Peptide), Sheraton Miyako Hotel, Tokyo, Japan, Feb. 25-27, 2014.

    [Biophysical Society_58th Annual Meeting]

    • 162. S. Kim, Y. Lee, K. W. Lee, "Effect of F156 and F364 Residues in Mouse TRESK for K+-channel Blockers using Molecular Dynamics Simulation with Lipid Bilayer." Biophysical Society_58th Annual Meeting, San Francisco, California, America, Feb. 15-19, 2014.
    • 161. Y. Lee, S. Kim, K. W. Lee, "Molecular Modeling Study of AtTrx-HS for Predicting Their Theromo-stability, Chaperone Function, and Oligomerization." Biophysical Society_58th Annual Meeting, San Francisco, California, America, Feb. 15-19, 2014.
    • 160. M. Son, C. Park, A. Baek, K. W. Lee, "Idendification of virtual candidates for human HMG-CoA reductase inhibitors using pharmacophore modeling and molecular dynamics simulation." Biophysical Society_58th Annual Meeting, San Francisco, California, America, Feb. 15-19, 2014.
    • 159. A. Baek, K. W. Lee, "Computational Mutation and Molecular Dynamics Simulations Studies for Fragaria vesca Alcohol Acetyltransferases to Increase Esterification Activities." Biophysical Society_58th Annual Meeting, San Francisco, California, America, Feb. 15-19, 2014.

    2013


    [2013 ´ëÇÑÀÇ·áÁ¤º¸ÇÐȸ ¹× Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ »ý¹°ÇÐȸ Ãß°èÇмú´ëȸ]

    • 158. P. G. Heo, Y. Lee, S. Kim, H. S. Lee, K. W. Lee, "VASOPRESSIN V2 Receptor Inhibitor Design using 3D QSAR Pharmacophore Modeling ." 2013 ´ëÇÑÀÇ·áÁ¤º¸ÇÐȸ ¹× Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ »ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Arpina Youth Hostel, Busan, Korea, Nov. 11-13, 2013.
    • 157. H. S. Lee, Y. Lee, S. Kim, P. G. Heo, K. W. Lee, "C5a Anphylatoxin Receptor Inhibitor Design using 3D QSAR Pharmacophore Modeling." 2013 ´ëÇÑÀÇ·áÁ¤º¸ÇÐȸ ¹× Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ »ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Arpina Youth Hostel, Busan, Korea, Nov. 11-13, 2013.
    • 156. S. Kim, Y. S. Sohn, C. Park, K. W. Lee, "Design of Novel mTOR Inhibitor using Pharmacophore Modeling." 2013 ´ëÇÑÀÇ·áÁ¤º¸ÇÐȸ ¹× Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ »ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Arpina Youth Hostel, Busan, Korea, Nov. 11-13, 2013.
    • 155. G. Cao, M. Arooj, M. Son, V. Arulalapperumal, K. W. Lee, "Classification Models of Sirtuin1 Activators and Least Activators Based on Neighborhood Classifier." 2013 ´ëÇÑÀÇ·áÁ¤º¸ÇÐȸ ¹× Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ »ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Arpina Youth Hostel, Busan, Korea, Nov. 11-13, 2013.
    • 154. V. Arulalapperumal, Y. Lee, M. Arooj, C. Park, A. Baek, G. Cao, K. W. Lee, "Prediction of Functionally Important Genes for Target Identification of Lung Cancer Disease from TGF- ¥â Induced Epithelial Mesenchymal Transition (EMT) Model Cells." 2013 ´ëÇÑÀÇ·áÁ¤º¸ÇÐȸ ¹× Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ »ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Arpina Youth Hostel, Busan, Korea, Nov. 11-13, 2013.
    • 153. Y. Lee, S. Kim, K. W. Lee, "Modeling Approach for Consensus Design of VLR Repeat Proteins: Relationship between Thermostability and Repeat Module Number." 2013 ´ëÇÑÀÇ·áÁ¤º¸ÇÐȸ ¹× Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ »ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Arpina Youth Hostel, Busan, Korea, Nov. 11-13, 2013.
    • 152. M. Arooj, K. W. Lee, "Finding Off-targets, Biological Pathways & Target Diseases for Chymase Inhibitors via Structure-based Systems Biology Approach." 2013 ´ëÇÑÀÇ·áÁ¤º¸ÇÐȸ ¹× Çѱ¹»ý¹°Á¤º¸½Ã½ºÅÛ »ý¹°ÇÐȸ Ãß°èÇмú´ëȸ, Arpina Youth Hostel, Busan, Korea, Nov. 11-13, 2013. [Oral presentation]

    [CMTPI 2013]

    • 151. V. Arulalapperumal, S. Thangapandian, S. John, S. Kim, M. Arooj, G. P. Cao, K. W. Lee, "Molecular Mechanism of Amino Acid Discrimination for the Editing Reaction of E.coli Leucyl-tRNA Synthetase." Computational Methods in Toxicology and Pharmacology Integrating Internet Resources 2013, Grand Hilton Hotel, Seoul, Korea, Oct. 8-12, 2013.
    • 150. Y. Lee, S. Kim, K. W. Lee, "Binding Mode Analyses and Pharmacophore Model Development for Stilbene Derivatives as a Novel and Competitive Class of a-Glucosidase Inhibitors." Computational Methods in Toxicology and Pharmacology Integrating Internet Resources 2013, Grand Hilton Hotel, Seoul, Korea, Oct. 8-12, 2013.
    • 149. G. Cao, M. Arooj, V. Arulalapperumal, K. W. Lee, "Comparison of k Nearest Neighbors and Neighborhood Classifier Systems for Classification Models of Sirtuin1 Activators and Least Activators." Computational Methods in Toxicology and Pharmacology Integrating Internet Resources 2013, Grand Hilton Hotel, Seoul, Korea, Oct. 8-12, 2013.

    [2013 International Symposium and Annual Meeting of the KSABC]

    • 148. E. Lee, K. W. Lee, "Novel Tyrosinase Inhibitor Design using Structure-based Pharmacophore Modeling." 2013 International Symposium and Annual Meeting of the KSABC, Haeundae Grand Hotel, Busan, Korea, Jun. 27-29, 2013.
    • 147. S. Kim, Y. Sohn, K. W. Lee, "Design of Novel mTOR Inhibitor using Pharmacophore Modeling." 2013 International Symposium and Annual Meeting of the KSABC, Haeundae Grand Hotel, Busan, Korea, Jun. 27-29, 2013.

    [2013 [Bio-IT World Asia Conference 2013]

    • 146. V. Arulalapperumal, S. Sakkiah, M. Arooj, G. Cao, K. W. Lee, "Prediction of Tolrestat Off-targets with Biological Pathways, Target Diseases by Validating Protein-Protein Interaction based on Chemical Systems Biology Approach." Bio-IT World Asia Conference 2013, Marina Bay Sands, Singapore, May. 28-31, 2013.

    [ICCMAS2013]

    • 145. K. W. Lee, M. Son, C. Park, A. Baek, "Molecular Mechanism of Amino Acid Discrimination for the Editing Reaction of E.coli Leucyl-tRNA Synthetase." International Conference on Computational Modeling, Analysis and Simulation 2013, Geroldswil Swiss Quality Hotel, Geroldswil Zurich, Switzerland, Jan. 14-15, 2013.
    • 144. M. Son, C. Park, A. Baek, S. John, K. W. Lee, "Discovery of Human HMG-Coa Reductase Inhibitors Using Structure-Based Pharmacophore Modeling Combined with Molecular Dynamics Simulation Methodologies." International Conference on Computational Modeling, Analysis and Simulation 2013, Geroldswil Swiss Quality Hotel, Geroldswil Zurich, Switzerland, Jan. 14-15, 2013.
    • 143. C. Park, S. Thangapandian, Y. Lee, M. Son, S. John, Y. Sohn, K. W. Lee, "Molecular Dynamic Simulation and Receptor-based Pharmacophore Modeling on Human Renin for Discovery of Novel Inhibitors." International Conference on Computational Modeling, Analysis and Simulation 2013, Geroldswil Swiss Quality Hotel, Geroldswil Zurich, Switzerland, Jan. 14-15, 2013.

    2012


    [DrugDesign2012]

    • 142. S. Kim, Y. Lee, K. W. Lee, "Identification of Blocker Binding Site in Mouse TRESK Potassium Channel by Molecular Modeling Study." in the DrugDesign2012, 1st International Conference and Exhibition, St Hilda's College, Oxford, UK, Sep. 26-28, 2012.
    • 141. Y. Lee, S. Kim, K. W. Lee, "Combined Approach of Molecular Docking and Molecular Dynamics Simulations for Stibene Derivatives as a Novel and Competitive Class of ??-Glucosidase Inhibitors." in the DrugDesign2012, 1st International Conference and Exhibition, St Hilda's College, Oxford, UK, Sep. 26-28, 2012.
    • 140. S. Kim, Y. Lee, K. W. Lee, "Identification of Blocker Binding Site and Critical Chemical Features for TREK-2 Potassium Channel by Molecular Docking Simulation and Structure-based Pharmacophore Modeling." in the DrugDesign2012, 1st International Conference and Exhibition, St Hilda's College, Oxford, UK, Sep. 26-28, 2012.

    2011


    [GIW2011]

    • 139. S. John, S. Thangapandian, M. Arooj, J. C. Hong, K. D. Kim, K. W. Lee, "Development, Evaluation and Application of 3D QSAR Pharmacophore Model in the Discovery of Potential Human Renin Inhibitors." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011. [Oral Presentation]
    • 138. S. Hwang, S. Thangapandian, Y. Lee, S. Sakkiah, S. John, K. W. Lee, "Discovery and Evaluation of Potential Sonic Hedgehog Signaling Pathway Inhibitors using Pharmacophore Modeling and Molecular Dynamics Simulations." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 137. Y. Lee, S. Kim, K. W. Lee, "Molecular Dynamics Simulation Study for Understanding of Electron Transfer Mechanism in Escherichia coli Thioredoxin Reductase." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 136. S. Kim, Y. Lee, K. W. Lee, "Homology Modeling of Mouse TRESK and Prediction of Potassium Channel Blocker Binding Site through Molecular Docking Simulations." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 135. M. Son, A. Baek, S. Sakkiah, C. Park, K. W. Lee, "Discovery of Human HMG-CoA Reductase Inhibitors Using Pharmacophore Modeling and Molecular Docking." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 134. C. Park, M. Son, K. W. Lee, "Investigation of Catalytic Mechanism of Type I Isopentenyl Diphosphate Isomerase through Molecular Dynamics Simulation." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 133. A. Baek, Y. Sohn, K. W. Lee, "Comparative Studies of Binding Modes between Fragaria Vesca Alcohol Acetyltransferases (VAAT) and Fragaria X Ananassa Alcohol Acetyltransferases (SAAT) with Same Alcohol Substrates by Molecular Modeling Study." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 132. Y. Sohn, Y. Lee, S. Kim, K. W. Lee, "Dynamic Pharmacophore Modeling of Peroxisome Proliferator-Activated Receptor ?? to Discover Novel Agonists." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 131. S. Kim, Y. Lee, Y. Sohn, K. W. Lee, "Matrix Metalloproteinase-3 Inhibitor Design using 3D QSAR Pharmacophore Modeling." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 130. M. Chandrasekaran, S. Sakkiah, K. W. Lee, "Combined Chemical Feature Based Assessment and Bayesian Model Studies to Identify Potential Inhibitors for Factor Xa." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 129. S. Thangapandian, S. John, K. W. Lee, "Molecular Dynamics Simulation Study and Hybrid Pharmacophore Model Development in Human LTA4H Inhibitor Design." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 128. S. Sakkiah, K. W. Lee, "Pharmacophore Based Virtual Screening, Molecular Docking and Density Functional Theory to Identify Novel Butyrylcholinesterase Inhibitors." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 127. G. P. Cao, S. Thangapandian, S. John, M. Arooj, V. Arulalapperumal, K. W. Lee, "A Hybrid GA/SVM Approach for Classification of HDAC8 Inhibitors." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 126. V. Arulalapperumal, S. Sakkiah, S. Thangapandian, Y. Lee, G. P. Cao, K. W. Lee, "Chemical System Biology Approach: Functional Site Analysis to Finding Drug off-target Effect of Aldose Reductase Inhibitors for Diabetes." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.
    • 125. M. Arooj, S. John, S. Hwang, G. P. Cao, S. Sakkiah, K. W. Lee, "Discovery of Human Chymase Inhibitors via Multiple Pharmacophore-Based Virtual Screening, Molecular Docking, and DFT Techniques." The 22nd International Conference on Genome Informatics, Haeundae Grand Hotel, Busan, Korea, Dec. 5-7, 2011.

    [TBC2011]

    • 124. S. Hwang, S. Thangapandian, K. W. Lee, "Molecular Dynamics Simulations of Sonic Hedgehog-Receptor and Inhibitor Complexes and Their Applications for Potential Anticancer Agent Discovery." Translational Bioinformatics Conference, Seoul National University College of Medicine, Seoul, Korea, Nov. 10-11, 2011. [Oral Presentation]
    • 123. M. Chandrasekaran, S. Sakkiah, Y. Lee, K. W. Lee, "Structure-based Pharmacophore Modeling and Molecular Dynamics Simulations Approaches to Design Potent Inhibitor for Interleukin-2-inducible T-cell Kinase." Translational Bioinformatics Conference, Seoul National University College of Medicine, Seoul, Korea, Nov. 10-11, 2011. [Oral Presentation]
    • 122. M. Arooj, S. Thangapandian, S. John, J. K. Park, K. W. Lee, "3D QSAR Analysis of Novel Chymase Inhibitors against Cardiovascular and Allergic Diseases: A Density Functional Theory and Docking Study." Translational Bioinformatics Conference, Seoul National University College of Medicine, Seoul, Korea, Nov. 10-11, 2011. [Oral Presentation]
    • 121. S. Thangapandian, S. John, M. Son, V. Arulalapperumal, K. W. Lee, "Development of Predictive QSAR Model and Its Application in the Discovery of Human Leukotriene A4 Hydrolase Inhibitors." Translational Bioinformatics Conference, Seoul National University College of Medicine, Seoul, Korea, Nov. 10-11, 2011. [Oral Presentation]

    [EMBO/EMBL Symposium]

    • 120. S. Sakkiah, K. W. Lee, "Molecular Dynamics Simulation Study for Nicotinamide Binding of Wild-type and Mutated Human Sirtuin2." EMBO/EMBL Symposium: Structure and Dynamics of Protein Networks, Heidelberg, Germany, Oct. 13-16, 2011.

    [APBC2011]

    • 119. S. John, S. Thangapandian, S. Sakkiah, K. W. Lee, "Potent BACE-1 inhibitor design using pharmacophore modeling, In Silico screening and molecular docking studies." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011. [Oral Presentation]
    • 118. S. Kim, Y. Lee, M. Son, A. Baek, K. W. Lee, "Prediction of binding conformation between human acetylcholinesterase and cytochrome c using molecular modeling methods." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 117. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Potential lead identification in the discovery of novel renin inhibitor : Application of ligand and structure-based pharmacophore models." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 116. M. Arooj, S. Thangapandian, S. John, K. W. Lee, "Pharmacophore modeling and molecular docking studies for the identification of new human chymase inhibitors." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 115. A. Baek, Y. Sohn, S. Kim, Y. Lee, K. W. Lee, "Comparative studies of binding modes between fragaria vesca alcohol acetyltransferases (VAAT) and fragaria x ananassa alcohol acetyltransferases (SAAT) with same alcohol substrates by molecular modeling study." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 114. C. Park, S. Thangapandian, S. John, M. Son, Y. Lee, K. W. Lee, "Molecular dynamics simulation study of renin with inhibitors and its application in receptor-based pharmacophore modeling." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 113. M. Son, C. Park, S. Kim, Y. Lee, K. W. Lee, "Ligand and structure based pharmacophore models in the identification of potent substrates for NAD(P)H:Quinon oxidoreductase1 (NQO1)." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 112. S. Hwang, S. Thangapandian, K. W. Lee, "Discovery and evaluation of inhibitory lead candidates for sonic hedgehog using pharmacophore model and molecular dynamics simulation." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 111. V. Arulalapperumal, S. Sakkiah, K. W. Lee, "Ligand based pharmacophore identification and molecular docking studies for growth factor receptor bound protein 2 inhibitors." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 110. Y. Lee, S. Kim, K. W. Lee, "Molecular modeling study of LPS recognition in TLR4-MD-2 complex." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 109. M. Chandrasekaran, S. Sakkiah, K. W. Lee, "Pharmacophore modeling, virtual screening approach to discover potent inhibitor for thrombin." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 108. S. Sakkiah, S. Thangapandian, S. John, M. Chandrasekaran, K. W. Lee, "Dynamic receptor-based pharmacophore development and its application in designing novel sirtuin 2 inhibitors." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.
    • 107. G. P. Cao, S. Thangapandian, S. John, K. W. Lee, "Classification of HDAC8 inhibitors and non-inhibitors using support vector machines." in the 9th Asia Pacific Bioinformatics Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Songdo Convensia, Incheon, Korea, Jan. 11-14, 2011.

    2010

    • 106. S. John, S. Thangapandian, K. W. Lee, "Molecular dynamics simulation and structure-based pharmacophore modeling in the discovery of potential cholesterol esterase inhibitors." in Celebrating computational biology, St. Catherine's College, University of Oxford, Oxford, United Kingdom, Sep. 12-15, 2010.
    • 105. S. Thangapandian, S. John, K. W. Lee, "Molecular docking and pharmacophore filtering in the discovery of dual-inhibitors for human leukotriene a4 hydrolase (hLTA4H) and leukotriene C4 synthase (hLTC4S)." in Celebrating computational biology, St. Catherine's College, University of Oxford, Oxford, United Kingdom, Sep. 12-15, 2010.
    • 104. A. Baek, S. Kim, M. Son, Y. Lee, K. W. Lee, "Homology homology modeling and molecular dynamics simulation study for arabidopsis thaliana small and basic intrinsic proteins (SIP)." in the 17th Annual Meeting of the Korean Biophysical Society, Yonsei-Samsung Library Building, University of Yonsei University, Korea, Jun. 25, 2010.
    • 103. S. Kim, Y. Lee, M. Son, A. Baek, K. W. Lee, "Binding mode analysis of human acetylcholinesterase with human cytochrome c using molecular docking methods." in the 17th Annual Meeting of the Korean Biophysical Society, Yonsei-Samsung Library Building, University of Yonsei University, Korea, Jun. 25, 2010.
    • 102. Y. Lee, S. Kim, K. W. Lee, "Macro-molecular docking study for human AChE WAT domain with human caveolin-1." in the 17th Annual Meeting of the Korean Biophysical Society, Yonsei-Samsung Library Building, University of Yonsei University, Korea, Jun. 25, 2010.
    • 101. S. Hwang, S. Thangapandian, Y. Lee, K. W. Lee, "Sonic hedgehog (SHH) inhibitor design by pharmacophore modeling and virtual screening." in the 105th spring meeting of the Korean Chemical Society, Songdo Convensia, Incheon, Korea, Apr. 29-30, 2010.
    • 100. Y. Lee, S. Kim, K. W. Lee, "Molecular docking study for glucokinase (GK) activators." in the 105th spring meeting of the Korean Chemical Society, Songdo Convensia, Incheon, Korea, Apr. 29-30, 2010.
    • 99. S. Sakkiah, S. Thangapandian, S. John, K. W. Lee, "Structure-based virtual screening for the discovery of novel potent HSP90 inhibitors." in the 105th spring meeting of the Korean Chemical Society, Songdo Convensia, Incheon, Korea, Apr. 29-30, 2010.
    • 98. S. John, S. Thangapandian, S. Sakkiah, K. W. Lee, "Molecular dynamics simulation detailing the importance of bile salts in human cholesterol esterase." in the 105th spring meeting of the Korean Chemical Society, Songdo Convensia, Incheon, Korea, Apr. 29-30, 2010.
    • 97. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Pharmacophore modeling and virtual screening for novel histone deacetylase 8 inhibitor design." in the 105th spring meeting of the Korean Chemical Society, Songdo Convensia, Incheon, Korea, Apr. 29-30, 2010.
    • 96. M. Chandrasekaran, S. Sakkiah, K. W. Lee, "Identify novel potential inhibitors for PDE5 using pharmacophore modeling and ligand-based virtual screening." in the 105th spring meeting of the Korean Chemical Society, Songdo Convensia, Incheon, Korea, Apr. 29-30, 2010.

    2009

    • 95. C. Park, Y. Lee, K. W. Lee, "Homology modeling and molecular dynamics study for Arabidopsis thaliana CONSTANS B-box motifs." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 94. P. Lazar, S. Thangapandian, Y. Lee, K. W. Lee, "Computational approach to ensure the stability of the favorable ATP binding site in Hfq." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 93. M. Son, A. Baek, S. Kim, Y. Lee, K. W. Lee, "Three dimensional structure determination of sirt1 by homology modeling method." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 92. S. Kim, Y. Lee, M. Son, A. Baek, K. W. Lee, "Molecular docking study on molecular interaction between human acetylcholinesterase and cytochrome c." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 91. Y. Lee, S. Kim, W. Y. Bang, J. D. Bahk, K. W. Lee, "Developing a reliable 3D structure of Arabidopsis RelA/SpoT homolog 1." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 90. A. Baek, S. Kim, M. Son, Y. Lee, K. W. Lee, "Molecular modeling study on Arabidopsis thaliana small and basic intrinsic proteins (SIP)." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 89. S. John, S. Thangapandian, S. Sakkiah, K. W. Lee, "Identification of novel indoleamine 2,3-dioxygenase inhibitors: Pharmacophore modeling and molecular docking studies." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 88. S. Sakkiah, M. Chandrasekaran, S. Thangapandian, S. John, K. W. Lee, "Identification of critical and selective features for Aurora-B and Aurora-A (B/A) kinase antagonist based on pharmacophore modeling." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 87. M. Chandrasekaran, S. Sakkiah, S. Thangapandian, K. W. Lee, "Pharmacophore design for anti-inflammatory agent targeting interleukin inducible 2 tyrosine kinase (Itk)." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 86. P. Gajendrarao, N. Krishnamoorthy, S. Thangapandian, K. W. Lee, "Structure-based pharmacophore modeling, virtual screening and molecular docking studies for CodWX protease." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 85. S. Thangapandian, S. John, S. Sakkiah, K. W. Lee, "Discovery of integrin VLA-4 antagonists: Pharmacophore modeling, virtual screening, molecular docking studies." in the Bioinfo 2009, The 10th International conference, Haeundae Grand Hotel, Busan, Korea, Nov. 4-6, 2009.
    • 84. Sugunadevi Sakkiah, Poornima, Sundarapandian, Navaneethakrishnan K, K. W. Lee, "Computational Simulation on Scavenger Decapping Enzyme with 5-[(1S)-1-(3-chlorophenyl) ethoxy] quinazoline-2, 4-diamine." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 83. Shalini John, *Sundarapandian, *Navaneethakrishnan K, Nawaz Khan, K. W. Lee, "Evaluation of Substituted 3-phenyl Isocoumarins as Bile Salt Activated Lipase Inhibitors by Molecular Docking Studies." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 82. Sundarapandian, Navaneethakrishnan K, Sugunadevi Sakkiah, *Shalini John, K. W. Lee, "Molecular Dynamics Study for the Identification of Ligand Specificity in HDAC8 and HDAC11." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 81. Prettina Lazar, K. W. Lee, "Molecular Modeling Study for ATP-Binding and its Effect in Hfq-RNA Complex." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 80. Poornima, Navaneethakrishnan K, Sugunadevi Sakkiah, K. W. Lee, "Probing Ligand Binding Sites and Entry/Egress Channels of Human Cytochrome P450 4A22." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 79. Navaneethakrishnan K, Poornima, Sundarapandian, K. W. Lee, "Possible Binding Sites and Entry Passage for Insulin B-Chain in ATP-dependent CodWX Protease using Molecular Modeling Study." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 78. Y. Sohn, Y. Lee, C. Park, S. Hwang, S. Kim, K. W. Lee, "Pharmacophore Identification of Human Peroxisome Proliferater-Activated Receptor¥ã." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 77. S. Hwang, Y. Lee, K. W. Lee, "Protein Engineering for New Epimerase through Flexible Molecular Docking Studies." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 76. A. Baek, S. Kim, Y. Lee, K. W. Lee, "3D Structure Determination of Arabidopsis thaliana Small and Basic Intrinsic Proteins (AtSIP) by Homology Modeling Method." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 75. C. Park, Y. Lee, K. W. Lee, "3D Structure Prediction of Full-length ANO1 using Multiple Fold-recognition Method." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 74. M. Son, S. Kim, Y. Lee, K. W. Lee, "Molecular Docking Study of Quinone Oxidoreductase (NQO) with Quinone Derivatives as New Inhibitor Candidates." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 73. S. Kim, Y. Lee, A. Baek, M. Son, K. W. Lee, "Interacting Site Prediction of Acetylcholinesterase with Cytochrome c by Molecular Docking and Molecular Dynamics Simulation Studies." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.
    • 72.Y. Lee, S. Kim, K. W. Lee, "Binding Mode Analysis of Human AChE with Human Caveolin-1 using Macro-molecular Docking Study." in The 103rd spring meeting of the Korean Chemical Society, COEX, Samsung City, Seoul, Korea, Apr. 16-17, 2009.

    2008

    • 71. A. Baek, S. Kim, Y. Lee, K. W. Lee, ¡°Structural Comparison of Human Argonaute 2 Protein with the Other Three Human Argonaute Proteins.¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008.
    • 70. S. Thangapandian, N. Krishnamoorthy, K. W. Lee, ¡°Pharmacophore Identification and Molecular Modeling Studies on Histone Deacetylase Isoforms.¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008.
    • 69. P. Lazar, Y. Lee, S. Kim, K. W. Lee, ¡°Molecular Modeling Study for Apo and Holo form of a Novel Metalloenzyme-DOHH.¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008.
    • 68. M. Son, S. Kim, Y. Lee, K. W. Lee, ¡°Molecular Docking Study of Quinone Oxidoreductase with Quinone Derivatives.¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008.
    • 67. S. Kim, Y. Lee, A. Baek, K. W. Lee, ¡°Homology Modeling and Molecular Dynamics Simulation Study on TRESK-2 from Two Pore Domain Potassium Channel(K2P).¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008.
    • 66. Y. Lee, S. Kim, K. W. Lee, ¡°Developing a Reliable 3D Structure of Arabidopsis CDSP32.¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008. [Outstanding Poster Award]
    • 65. S. Sakkiah, P. Gajendrarao, N. Krishnamoorthy, K. W. Lee, ¡°Computer-Adided Inhibitor Design on Aurora Kinase A Protein.¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008.
    • 64. N. Krishnamoorthy, P. Gajendrarao, S. Thangapandian, K. W. Lee, ¡°Characterizing Structural Patterns of Nickel Interacting Proteins in Helicobacter pylori.¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008.
    • 63. P. Gajendrarao, N. Krishnamoorthy, S. Sakkiah, K. W. Lee, ¡°Bioinformatics Study for Evolutionary Trace of the Proteins Important for Chitin and cellulose Degradation.¡± in The 9th International Conference of Korean Society for Bioinformatics and Systems Biology (KSBSB), Chungbuk National University (CBNU), Cheongju City, Korea, Nov. 13-14, 2008.
    • 62. S. Kim, Y. Lee, A. Baek, K. W. Lee, "Homology Modeling and Molecular Dynamics Simulation Study for TREK-2 Potassium Channel." in The 102nd National Meeting of Korean Chemical Society, International Convention Center(ICC), Jeju, Korea, Oct. 16-17, 2008. [ PDF ]
    • 61. Y. Lee, S. Kim, K. W. Lee, "Structural Analysis of Arabidopsis NADPH-dependent Thioredoxin Reductase between Isotype A and C using Molecular Dynamics Simulations." in The 102nd National Meeting of Korean Chemical Society, International Convention Center(ICC), Jeju, Korea, Oct. 16-17, 2008. [ PDF ]
    • 60. P. Lazar, K. W. Lee, "Interaction Of Host Factor Protein With RNA Under Different Ionic Strengths - A Molecular Dynamics Simulation Approach." in Joint 7th ECCB Conference and 5th BITS Meeting, ECCB'08 - European Conference on Computational Biology, Cagliari, Sardinia-Italy, Sep 22-26, 2008.
    • 59. P. Gajendrarao, N. Krishnamoorthy, K. W. Lee, "Molecular Modeling Study of Orphan Human Cytochrome P450 4A22." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 58. N. Krishnamoorthy, P. Gajendrarao, K. W. Lee, "A Molecular Dynamics Approach for the Structural Behavior of Human Cytochrome P450 3A4 with Erythromycin and Ketoconazole." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 57. K. Bharatham, N. Bharatham, K. W. Lee, "Role of Inositol Hexakisphosphate Co-factor in TIR1-Substrate Interactions by Molecular Modeling study." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 56. N. Bharatham, K. Bharatham, K. W. Lee, "Molecular Dynamics Simulation Study for Pre- and Post-transfer Substrate Binding of ValRS Editing Reaction." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 55. Y. Lee, W. Y. Bang, K. W. Lee, "Binding Mode Analysis of Bacillus subtilis Obg with Ribosomal Protein L13 using Macro-molecular Docking Study." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 54. P. Lazar, K. W. Lee, "Effect of Ionic Strength on RNA-binding Protein Complex Conformation - A Molecular Dynamics Simulation Approach." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 53. S. Liu, K. W. Lee, "Molecular Modeling Study for Interaction Between urokinase-type Plasminogen Activator and Inhibitor." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 52. C. Park, Y. Lee, S. Kim, A. Baek, K. W. Lee, "Molecular Dynamics Simulation Study on Four Different PAZ Domains." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 51. A. Baek, J. Park, S. Kim, Y. Lee, C. Park, K. W. Lee, "Three Dimensional Structure Determination of Human Argonaute2 Protein by Homology Modeling Method." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.
    • 50. S. Kim, Y. Lee, C. Park, A. Baek, K. W. Lee, "Analysis of Four Domains Motion of A. aeolicus Argonaute Protein with siRNA using Molecular Dynamics Simulations." in The 101st Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 17-28, 2008.

    2007

    • 49. P. Gajendrarao, N. Krishnamoorthy, S. Y. Lee, K. W. Lee, ¡°Molecular Dynamics Simulations Study on Human Cytochrome P450 3A4 with Substrates: Mutation Effect of L293P.¡± in The International Conference on Bioinformatics and Drug Dicovery, University of Hyderabad, India, Dec. 20-22, 2007.
    • 48. N. Krishnamoorthy, P. Gajendrarao, S. Y. Lee, K. W. Lee, ¡°Molecular Modeling Study Reveals the Complex Structure and the Mechanism of CodWX Protease.¡± in The International Conference on Bioinformatics and Drug Dicovery, University of Hyderabad, India, Dec. 20-22, 2007.
    • 47. K. Bharatham, N. Bharatham, J. D. Bahk, K. W. Lee,¡°Receptor Based Dynamic Pharmacophore Model for PTP1B Allosteric Site.¡± in The 8th International Conference of Korean Society for Bioinformatics(KSBI), KRIBB, Daejeon City, Korea, Nov. 15-16, 2007.
    • 46. N. Bharatham, K. Bharatham, J. D. Bahk, K. W. Lee,¡°Molecular Dynamics Simulation Study for Pre-transfer Editing Reaction of Valyl-tRNA Synthetase.¡± in The 8th International Conference of Korean Society for Bioinformatics(KSBI), KRIBB, Daejeon City, Korea, Nov. 15-16, 2007.
    • 45. E. Lee, Y. Lee, J. D. Bahk, K. W. Lee, ¡°Molecular Docking Study and Homology Modeling for the Indol oxygenase.¡± in The 8th International Conference of Korean Society for Bioinformatics(KSBI), KRIBB, Daejeon City, Korea, Nov. 15-16, 2007.
    • 44. Y. Lee, J. D. Bahk, K. W. Lee, ¡°Structural Analysis of Bacillus subtilis Obg with Nucleotides using Molecular Dynamics Simulations.¡± in The 8th International Conference of Korean Society for Bioinformatics(KSBI), KRIBB, Daejeon City, Korea, Nov. 15-16, 2007.
    • 43. S. Kim, Y. Lee, J. D. Bahk, K. W. Lee, ¡°Molecular Modeling Study on P. furiosus Argonaute and A.aeolicus Argonaute Proteins.¡± in The 8th International Conference of Korean Society for Bioinformatics(KSBI), KRIBB, Daejeon City, Korea, Nov. 15-16, 2007.
    • 42. P. Lazar, K. Bharatham, J. D. Bahk, K. W. Lee, ¡°Molecular Dynamics Study of the S. Aureus Hfq Reveals the Effect of Modified Chain Conformation on RNA Bound to Hfq.¡± in The 8th International Conference of Korean Society for Bioinformatics(KSBI), KRIBB, Daejeon City, Korea, Nov. 15-16, 2007.
    • 41. Y. Lee, N. Krishnamoorthy, K. W. Lee, ¡°Linking of Two Key Domains in AtTDX using Computer Modelling Methods.¡± in The 99th Annual Meeting of Korean Chemical Society, COEX, Seoul, Korea, Apr. 19-20, 2007.
    • 40. Y. Lee, K. W. Lee, ¡°Structural and Functional Insight for Ring Opening of Rare Sugar Molecules by D-Psicose 3-Epimerase.¡± in The 99th Annual Meeting of Korean Chemical Society, COEX, Seoul, Korea, Apr. 19-20, 2007.
    • 39. J. Park, Y. Lee, K. W. Lee, ¡°Molecular Modeling Study on Peroxisome Proliferator-Activated Receptor-¥ã and its Ligands.¡± in The 99th Annual Meeting of Korean Chemical Society, COEX, Seoul, Korea, Apr. 19-20, 2007. [Outstanding Poster Award]
    • 38. P. Lazar, K. W. Lee, ¡°Molecular Dynamics Simulation Study on RNA Binding Protein Hfq.¡± in The 99th Annual Meeting of Korean Chemical Society, COEX, Seoul, Korea, Apr. 19-20, 2007.
    • 37. S. Liu, N. Krishnamoorthy, K. W. Lee, ¡°Molecular Dynamics Simulation Study for Interaction Between urokinasetype Plasminogen Activator and its Inhibitor.¡± in The 99th Annual Meeting of Korean Chemical Society, COEX, Seoul, Korea, Apr. 19-20, 2007.
    • 36. N. Krishnamoorthy, P. Gejendrarao, K. W. Lee, ¡°MicroRNA - A Molecular Modeling Approach to Human Negative Gene Regulation.¡± in The 99th Annual Meeting of Korean Chemical Society, COEX, Seoul, Korea, Apr. 19-20, 2007.
    • 35. P. Gejendrarao, N. Krishnamoorthy K. W. Lee, ¡°Molecular Modeling Studies with Wild Type and Mutant Structures of Human Microsomal Cytochrome P450.¡± in The 99th Annual Meeting of Korean Chemical Society, COEX, Seoul, Korea, Apr. 19-20, 2007.

    2006

    • 34. Chandrasekar R., Dhanalakshmi T. R., K. C. Chang , K. W. Lee, ¡°Molecular Evolution Structural Analysis of Galleria mellonella HCH Ferritins.¡± in The 5th International Conference of APBioNet as InCoB held in New Delhi, India on Dec. 18-20, 2006.
    • 33. N. Bharatham, K. Bharatham, K. W. Lee,¡°Receptor Based Pharmacophore Design for Non-Sugar Derivatives, a New Class of a-Glucosidase Inhibitors.¡± in The 5th International Conference of APBioNet as InCoB held in New Delhi, India on Dec. 18-20, 2006.
    • 32. K. Bharatham, N. Bharatham, K. W. Lee, ¡°Pharmacophore Based PTP1B Inhibitor Design, virtual Screening and their Binding Analyses by MD Simulation Study.¡± in The 5th International Conference of APBioNet as InCoB held in New Delhi, India on Dec. 18-20, 2006.
    • 31. N. Krishnan, K. W. Lee,¡°Structure Prediction and Analysis for ATP-dependant Protease B. subtilis CodWX.¡± in The 7th International Conference of Korean Society for Bioinformatics(KSBI), POSTECH, Pohang City, Gyeongsang Buk-Do, Korea, Sept. 14-16, 2006.
    • 30. N. Krishnan, P. G. Rao, K. W. Lee, ¡°B-Z DNA Structural Transition Study by Computer Simulations.¡± in The 7th International Conference of Korean Society for Bioinformatics(KSBI), POSTECH, Pohang City, Gyeongsang Buk-Do, Korea, Sept. 14-16, 2006.
    • 29. Y. Lee, N. Krishnamoorthy, K. W. Lee, ¡°Molecular Dynamics Simulation Study on Adenosine Kinase.¡± in The 7th International Conference of Korean Society for Bioinformatics(KSBI), POSTECH, Pohang City, Gyeongsang Buk-Do, Korea, Sept. 14-16, 2006.
    • 28. K. Bharatham, N. Bharatham, P. A. Louis K. W. Lee, "Molecular Dynamics Simulation Study on Promyelocytic Leukemia Zinc Finger BTB/POZ Domain." in The 7th International Conference of Korean Society for Bioinformatics(KSBI), POSTECH, Pohang City, Gyeongsang Buk-Do, Korea, Sept. 14-16, 2006.
    • 27. K. Bharatham, N. Bharatham, K. W. Lee, ¡°Pharmacophore Hypothesis Identification, Evaluation and Subsequent Screening by In silico methods for P56 LCK Inhibitors." in The 7th International Conference of Korean Society for Bioinformatics(KSBI), POSTECH, Pohang City, Gyeongsang Buk-Do, Korea, Sept. 14-16, 2006.
    • 26. N. Bharatham, K. Bharatham K. W. Lee,¡°Analysis of the Binding Mode for Sulfonamide Chalcone Derivatives, a New Class of ¥á-Glucosidase Inhibitors.¡± in The 7th International Conference of Korean Society for Bioinformatics(KSBI), POSTECH, Pohang City, Gyeongsang Buk-Do, Korea, Sept. 14-16, 2006.
    • 25. J. Park, N. Bharatham, K. Bharatham, K. W. Lee,¡°Computer-Aided Drug Design on Peroxisome Proliferator-Activated Receptor-¥ã (PPAR¥ã) Agonists.¡± in The 7th International Conference of Korean Society for Bioinformatics(KSBI), POSTECH, Pohang City, Gyeongsang Buk-Do, Korea, Sept. 14-16, 2006.
    • 24. S. Liu, N. Bharatham, K. Bharatham K. W. Lee, ¡°Pharmacophore Identification and Molecular Docking Study on Tissue-type Plasminogen Activator (tPA) Inhibitor.¡± in The 7th International Conference of Korean Society for Bioinformatics(KSBI), POSTECH, Pohang City, Gyeongsang Buk-Do, Korea, Sept. 14-16, 2006.
    • 23. N. Bharatham, K. Bharatham, K. W. Lee, "Methionyl-tRNA Synthetase, an Unexploited Antibacterial Target Inhibitor Design." in The 97th Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 20-21, 2006.
    • 22. K. Bharatham, N. Bharatham, K. W. Lee, "PTP1B Inhibitor Design with Drug Like Properties Developed by In silico Methods." in The 97th Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 20-21, 2006.
    • 21. S. Liu, N. Bharatham, K. Bharatham, K. W. Lee, "Urokinase Inhibitor Design using Ligand and Receptor Based Methods." in The 97th Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 20-21, 2006.
    • 20. Y. Lee, N. Bharatham, K. Bharatham, E. Lee, K. W. Lee, "Docking Studies of Pharmacophore Model Based Adenosine Kinase Inhibitors." in The 97th Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 20-21, 2006.
    • 19. K. Navaneethakrishnan, L. Shui, K. W. Lee, "In silico Simulations of E. coli HslVU to Explore B. subtilis CodWX Structure." in The 97th Annual Meeting of Korean Chemical Society, KINTEX, Goyang City, Kyeonggi-Do, Korea, Apr. 20-21, 2006.

    2005

    • 18. K. Bharatham, N. Bharatham, K. W. Lee, "Novel Inhibitor Design for P56 LCK using Analog and Structure Based Drug Design." in BIOINFO2005, joint international conference of AASBi, InCoB and KSBI, BEXCO, Busan, KOREA, Sep. 22-24, 2005.
    • 17. N. Bharatham, K. Bharatham, S.Vadivelan, K. W. Lee, "Computer-Aided Inhibitor Design for Methionyl-tRNA Synthetase." in BIOINFO2005, joint international conference of AASBi, InCoB and KSBI, BEXCO, Busan, KOREA, Sep. 22-24, 2005. [Outstanding Poster Award]
    • 16. K. Bharatham, N. Bharatham, K. W. Lee, "Innovative Chemical Database Design for Drug Discovery." in Annual Meeting of Korean Society of Life Science , Gyeongsang National University, Jinju, KOREA, April 8-9, 2005.
    • 15. N. Bharatham, K. Bharatham, K. W. Lee, "Quantitative Structure-Activity Relationships (QSAR) and Molecular Docking Studies of P56 LCK Inhibitors." in Annual Meeting of Korean Society of Life Science , Gyeongsang National University, Jinju, KOREA, April 8-9, 2005.

    2003

    • 14. Jinxia Deng, K. W. Lee, J. M. Briggs "Identify Potential Drugs Targeted to HIV-1 Integrase using Pharmacophore Models Developed Based on the MD Snapshots." in 8th Annual Structural Biology Symposium at UTMB Galveston, TX, USA, May 2-4, 2003
    • 13. K. W. Lee, J. M. Briggs "Amino Acid Discrimination by Threonines in the Editing Reaction of Class Ia tRNA Synthetases." in 8th Annual Structural Biology Symposium at UTMB Galveston, TX, USA, May 2-4, 2003
    • 12. Yuxin Zhal, K. W. Lee, E. Kirkbride, J. M. Briggs, S. A. Martinis "Mutational Analysis of the Leucyl-tRNA Synthetase Editing Active Site." in 8th Annual Structural Biology Symposium at UTMB Galveston, TX, USA, May 2-4, 2003
    • 11. J. Deng, K. W. Lee, J. M. Briggs "Prediction of New HIV-1 Integrase Lead Inhibitors using Dynamics Pharmacophore Models based on MD Snapshots." in the 225th ACS National Meeting, New Orleans, LA, USA, March 23-27, 2003
    • 10. A.Brigo, K. W. Lee, F. Fogolari, G. I. Mustata, J. M. Briggs "Comparative Molecular Dynamics Studies on HIV-1 Integrase Wild Type and T66I/M154I: New Insight into L-731,988 Binding Modes and Double Mutant Drug-resistance." in the 225th ACS National Meeting, New Orleans, LA, USA, March 23-27, 2003

    2002

    • 9. K. W. Lee, J. M. Briggs "Molecular Dynamics Simulation of the HIV-1 Integrase Dimer Structure for Catalytic Core and C-Terminal Domains." in Keck Center Annual Research Conference at Tremont House Ballroom, Galveston, TX, USA, May 17-19, 2002
    • 8. J. Deng, K. W. Lee, J. M. Briggs "Identify Potential Drugs Targeted to HIV-1 Integrase Using Pharmacophore Models Developed Based on the MD Snapshots." in Keck Center Annual Research Conference at Tremont House Ballroom, Galveston, TX, USA, May 17-19, 2002

    2001

    • 7. K. W. Lee, J. M. Briggs "Molecular Modeling of Polyamine binding to the OmpF Porin Protein." in Keck Center Annual Research Conference at Tremont House Ballroom, Galveston, TX, USA, Sept. 21, 2001
    • 6. K. W. Lee, R. S. Mursinna, S. Martinis, J. M. Briggs "Molecular Modeling to Elucidate the Role of the Conserved Threonine 252 Residue in the Editing Mechanism of Escherichia coli Leucyl-tRNA Synthetase" in Keck Center Annual Research Conference at Tremont House Ballroom, Galveston, TX, USA, Sept. 21, 2001
    • 5. R. S. Mursinna, K. W. Lee, S. Martinis, J. M. Briggs "Noncognate and Cognate Amino Acid Recognition and Editing by Escherichia coli Leucyl-tRNA Synthetase" in Keck Center Annual Research Conference at Tremont House Ballroom, Galveston, TX, USA, Sept. 21, 2001 [1st Award]
    • 4. K. W. Lee, J. M. Briggs "Molecular Dynamics Simulation Study of CP1 Domain of Escherichia coli Leucyl-tRNA Synthetase: The Role of T252 in Editing Reaction." in 6th Annual Structural Biology Symposium at UTMB Galveston, TX, USA, May 18-20, 2001
    • 3. R. S. Mursinna, T. L. Lincecun Jr., K. W. Lee, S. A. Martinis, J. M. Briggs "Cognate Amino Acid discrimination within the Escherichia coli Leucyl-tRNA Synthetase Editing Active Site." in 6th Annual Structural Biology Symposium at UTMB Galveston, TX, USA, May 18-20, 2001 [1st Award]
    • 2. R. S. Mursinna, K. W. Lee, J. M. Briggs, S. Martinis "Amino Acid discrimination within the E. coli Leucyl-tRNA Synthetase Editing Active Site." in SIGMA XI Contest, Houston, TX, USA, 2001 [1st Award]
    • 1. R. S. Mursinna, K.W. Lee, S. Martinis, J. M. Briggs "Cognate Amino Acid discrimination within the Escherichia coli Leucyl-tRNA Synthetase Editing Active Site." at University of Houston, Houston, TX, USA, 2001 [1st Award]






    4. Invited Talks / ÃÊû°­¿¬: 100 ¿©°Ç ÀÌ»ó

    • NIH(Korea National Institute of Health/±¹¸³º¸°Ç¿ø), Cheongju, Korea (2023/12/06)

    • KoSAIDs2023(´ëÇÑ¿¡ÀÌÁîÇÐȸ) by Korean Society for AIDS, Rahan Hotel, Jeonju, Korea (2023/11/17)

    • KSBMR2023(Çѱ¹°ñ´ë»çÇÐȸ) by Korean Society of Bone and Mineral Research, Walkerhill Hotel, Seoul, Korea (2023/05/19)

    • MRC Conference 2022 by Medical Research Center of Konkuk Univerity, Chungju, Korea (2022/07/09)

    • 2022 International Symposium and Annual Meeting by KoSPoST(Korean Society of Food Science and Technology), BEXCO, Busan, Korea (2022/07/06)

    • Chosun University, Department of Medical Engineering, Gwangju, Korea (2022/04/29)

    • Onconic Therapeutics, Seoul, Korea (2022/02/23)

    • Kyeongnam University, Department of Science Education, Changwon, Korea (2022/02/09)

    • AVELOS Therapeutics, Seoul, Korea (2021/12/17)

    • ...

    • AHeDD2019 (by Asian Hub for eDrug Discovery), Kawasaki, Japan (2019/11/27)

    • Samyang Inc., Insititute of Chemsitry, Daejeon, Korea (2019/10/10)

    • KSMCB2019 (by Korean Society for Molecular & Cellular Biology) at Convention and Exhibition Center (COEX), Seoul, Korea (2019/10/01)

    • Gwangju Insititute of Science and Technology(GIST), Gwangju, Korea (2019/09/05)

    • BIOINF2019 (by Korean Society for Bioinformatics, KSBi) at Ewha Womans University, Seoul, Korea (2019/08/26)

    • Gyeongsang Natinal University, College of Medicine, Jinju, Korea (2019/08/19)

    • Seoul Natinal University, College of Medicine, Seoul, Korea (2019/05/20)

    • Seoul Natinal University, College of Medicine, Seoul, Korea (2018/09/10)

    • AHeDD2018 at KIST(Korea Insititute of Science and Technology at Kangnung), Kangnung, Korea (2018/09/26)

    • Hanbat Natinal University, Department of Biotechnology, Daejeon, Korea (2018/07/09)

    • Seoul Natinal University, IBS(Institute for Basic Science) for Genome Editing, Seoul, Korea (2018/02/08)

    • Seoul Natinal University, IBS(Institute for Basic Science) for Genome Editing, Seoul, Korea (2018/02/08)

    • KIPO(Korean Intellectual Property Office), Daejeon, Korea (2017/06/07)

    • GNU-MU(University of Missouri) Joint Symposium at Missouri University, Columbia, MO, USA (2017/05/08)

    • BIOINF2017 at Yonsei University, Seoul, Korea (2017/03/22)

    • ...

    • BIOINF2014 at Yonsei University, Seoul, Korea (2014/11/13)

    • KU(University of Copenhagen)-GNU Joint Symposium at GNU (Gyeongsang National University), Jinju, Korea (2014/11/04)

    • Korea National Institute of Health (KNIH), Chungju, Korea (2014/7/14)

    • Kangwon National University, Vascular Research Center, Chuncheon, Korea (2014/7/12)

    • APBC2014 (Asia-Pacific Bioinformatics Conference 2014) ICC Jeju, Korea (2014/5/18)

    • Water Research Center at Hanbat National University, Daejeon, Korea (2014/5/9)

    • CADD (Computer-Aided Drug Design) Workshop at Soongsil University, Seoul, Korea (2014/2/18)

    • GNU-MU(University of Missouri) Joint Symposium at Missouri University, Columbia, MO, USA (2013/05/07)

    • ...

    • 57. GNU-MU(University of Missouri) Joint Symposium at GNU, Jinju, Korea (2011/10/10))

    • 56. Yonsei University, Department of Material Science and Engineering, Seoul, Korea (2011/5/13)

    • 55. Kangwon National University, Colloge of Biomedical Science, Chuncheon, Korea (2011/3/4)

    • 54. APBC2011 (Asia-Pacific Bioinformatics Conference 2011: http://sysbio.kribb.re.kr/APBC2011) Songdo-Convensia, Incheon, Korea (2011/1/11-14)

    • 53. Changwon National University, Genetic Engineering Insititute, Changwon, Korea (November 11, 2010)

    • 52. Gyeongsang National University, Jinju, Korea (November 10, 2010)

    • 51. InCOB2010 (International Conference on Bioinformatics: http://incob10.hgc.jp), Waseda University, Tokyo, Japan (Sep. 26-28, 2010)

    • 50. Korea Food and Drug Administration, Seoul, Korea (July 14, 2010)

    • 49. Ahi Evran University, Department of Physics, Kirsehir, Turkey (June 29-July 8, 2010)

    • 48. Gyeongsang National University, College of Medicine, Jinju, Korea (May 28, 2010)

    • 47. CBI-KSBSB Joint Conference(BIOINFO 2009) Pusan, Korea (Nov. 4-7, 2010)

    • 46. Kyeong Hee University, KOGO Workshop, Seoul, Korea (July 14, 2009)

    • 45. Seoul National University, KSBSB Workshop, Seoul, Korea (July 3, 2009)

    • 44. Pusan National University, Department of Physics, Pusan, Korea (June 26, 2009)

    • 43. Pusan National University, Open Access Forum, Pusan, Korea (May 29, 2009)

    • 42. Korea Advanced Institute of Science and Technology (KAIST), Department of Life Science, Daejeon, Korea (May 26, 2009)

    • 41. Gwangju Institute of Science and Technology (GIST), Department of Life Science, Gwangju, Korea (May 20, 2009)

    • 40. Korea University at Sejong, Department of Bioinformatics, Jochiwon, Korea (March 24, 2009)

    • 39. Korea-Japan Protein Research Symposium, KIAS, Seoul, Korea (February 26, 2009)

    • 38. GNU Interdisciplinary Life Science Symposium, Gyeongsang National Univerisity, Jinju, Korea (February 6, 2009)

    • 37. Korean Society of Bioinformatics and Systems Biology (KSBSB) CADD symposium, Soongsil Univerisity, Seoul, Korea (February 3, 2009)

    • 36. Korea Genome Organization (KOGO) 2009 Winter symposium, Yongphyeong resort, Pyeongchang, Korea (January 15, 2009)

    • 35. Nanobio-Seoul 2008, Yonsei University, Seoul, Korea (October 31, 2008)

    • 34. Choongnam National University, College of Medicine, Seoul, Korea (October 2, 2008)

    • 33. Ewha Wamans University, College of Pharmacy, Seoul, Korea (September 18, 2008)

    • 32. Research Center of Yuhan (Pharmaceutical) Corporation, Yongin, Korea (August 29, 2008)

    • 31. Bioinformatics and Molecular Design and Research Center at Yonsei University, Seoul, Korea (August 21, 2008)

    • 30. Computer-Aided Drug Design Workshop at Sukmyeong Wamans University, Seoul, Korea (June 13, 2008)

    • 29. The 8th International Conference of Korean Society for Bioinformatics BIOINFO2007 at KRIBB, Daejeon, Korea (November 15, 2007)

    • 28. The 2nd GNU-MU(University of Missouri) Joint Symposium at Missouri University, Columbia, MO, USA (October 3, 2007)

    • 27. The 3rd Molecular Computation Initiative Workshop, Pusan, Korea (August 27, 2007)

    • 26. Gyeongsang National University, College of Medicine, Jinju, Korea (August 7, 2007)

    • 25. Inje University, Department of Biotechnology, Kimhae, Korea (April 12, 2007)

    • 24. Jinju National University, Department of Animal Science & Technology, Jinju, Korea (March 20, 2007)

    • 23. Korea Institute for Advanced Study (KIAS), Workshop on Protein Science, Seoul, Korea (December 28, 2006)

    • 22. Gyeongsang National University, Department of Chemistry, Jinju, Korea (October 13, 2006)

    • 21. Sungkyunkwan University, Department of Chemistry, Suwon, Korea (October 12, 2006)

    • 20. University of Missouri, Columbia(UMC)-Gyeongsang National University(GNU) Joint Symposium, Jinju, Korea (October 10, 2006)

    • 19. KyungHee University, Department of Chemistry, Seoul, Korea (January 18, 2006)

    • 18. Gyeongnang University, Science-Gifted Education Center, Masan, Korea (November 5, 2005)

    • 17. Chungbuk National University, Department of Chemistry, Chungju, Korea (October 13, 2005)

    • 16. Gyeongsang National University, Science-Gifted Education Center, Jinju, Korea (July 25, 2005)

    • 15. Gyeongsang National University, National Core Research Center (NCRC)Summer Program, Jinju, Korea (July 14, 2005)

    • 14. Busan Science Academy(High School), Busan, Korea (June 17, 2005)

    • 13. Sunchon National University, Department of Chemistry, Sunchon, Korea (April 28, 2005)

    • 12. Yeungnam University, School of Biotechnology, Gyeongsan, Korea (April 8, 2005)

    • 11. Seoul National University, Department of Chemistry, Seoul, Korea (March 24, 2005)

    • 10. Gyeongsang National University, For Cowork with Samsung Advanced Institute of Technology (SAIT), Jinju, Korea (March 15, 2005)

    • 9. National Core Research Center (NCRC) Anuual Meeting, Muju, Korea (February 1, 2005)

    • 8. Gyeongsang National University, National Core Research Center (NCRC), Jinju, Korea (November 19, 2004)

    • 7. Seoul National University, College of Pharmacy, Seoul, Korea (October 25, 2004)

    • 6. Seoul National University, School of Life Science, Seoul, Korea (October 25, 2004)

    • 5. Gyeongsang National University, Next generation BioTechnology Reseach Association (NBTRA), Jinju, Korea (August 28, 2004)

    • 4. Gyeongsang National University, Department of Biochemistry, Jinju, Korea (July 19, 2004)

    • 3. Kangwon National University, Vascular System Research Center (VSRC), Chunchon, Korea (June 22, 2004)

    • 2. GIST (Gwangju Instititue of Science ans Technology), Department of Life Science, Gwangju, Korea (June 7, 2004)

    • 1. Yonsei University, Department of Biotechnolgy, Seoul, Korea (June 4, 2004)




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