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°·±d¬O«~½è¥Í¬¡ªº°ò¥»n¯À¡C·LÆ[§ó²`¤J²z¸Ñ¥Íª«¤À¤l¦p¦ó»P¨ä¥L¥Íª«¤À¤l§@¥Î¡A¥H¤Î°tÅé¦p¦ó»P¥Íª«¤À¤l§@¥Î´£ª@§Ú̦b¥Íª«¡BÃĪ«¤Æ¾Ç»â°ìªºª¾ÃÑ¡C³o¨Çª¾ÃÑÀ°§U§Ú̼W¶i°·±d¡A¹w¨¾¥Í¯f©MªvÀø¯e¯f¡C§Ú̹êÅç«Ç¨Ï¥Î¹q¸£¨Ãµ²¦Xª«²z¤Æ¾Çì²z¡A¬ã¨sÂå¾Ç¡AÃľǡA¥Íª«¾Çªº¬ã¨s½ÒÃD¡C
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³z¹L¤À¤l¼ÒÀÀ¤èªk¨ó§U¥[³tÃĪ«ªº³]p¤Îµo²{ ¥Ø«e¶°¤¤¦bÀù¯g¤Î¯«¸g°h¤Æ©Ê¯e¯fÃĪ«¬ãµo¤W ¥Dn±´°QÃĪ«¤Î¦³Ãĩʼç¤O¤Æ¦Xª«»P¥Ø¼Ð¥Í¤Æ¤À¤l¤§¶¡§@¥Î¤O¤Î¨äì²z ¥H¤Î²ÓM¤¤¥Í¤Æ¤ÏÀ³ºô¸ô¤§°Ê¤O¾Ç ³o¤è±µÛ«ªº¬O Àù²ÓM»P¥¿±`²ÓM¥Í¤Æ¤ÏÀ³ºô¸ô¤§°Ê¤O¾Çªº®t²§
¹B¥Î¤èªk¥]§t: ¤À¤l°Ê¤O¾Ç¼ÒÀÀ¡BDocking (please
see movies of docking computation here)¡B¨t²Î¥Íª«¾Ç¤èªk¡BQSARµ¥¡C
¼ç¤OÃĪ«¤Æ¦Xª«»P¼Ð¹v³J¥Õ½è¤§¶¡ªº§@¥Î (interaction
between potential drug compound and target protein):
¤@Ó²ÓM°T®§¶Ç»¼¤§¥Í¤Æ¤ÏÀ³ºô¸ô, wnt
¸ô®|, »P´XºØÀù¯g¦³Ãö,¯S§O¬O¤j¸zª½¸zÀù(reaction network of a cell signaling pathway: the
wnt pathway. This pathway is relevant to a number of cancers, particularly
colorectal cancer.):
¦¹¥~ ¤]±¾¤W¹êÅç«Ç¥ý«e¤@¬ã¨s¥DÃD-³J¥Õ½èºPÅ|-ªº¤@Ó¬ã¨sµ²ªG¡GÐ`肽Áä§éÅ|(¤@Ósimulation movie!)¡C
Research
Health is an essential element of quality
life. Deeper understandings of how biomolecules
interact with other biomolecules and how ligands interact with biomolecules
microscopically enhance our knowledge in medicinal chemistry area. The enhanced
knowledge are useful for enhancing health, preventing
from illness, and curing diseases. Our lab uses computer combined with physical
chemistry principles to study medical, pharmaceutical, and biological research topics.
What we
are doing are mainly using computational chemistry methods to explore
bio-related issues, mainly focusing on direction of drug development/discovery.
Through molecular modeling, we want to help/speed-up process of drug design and
discovery. Currently, we focus on cancer and neurodegenerative diseases. We are
looking at binding of drug and/or potential compounds with target bio-molecules
and their binding principles. In addition to this, we are also looking at
kinetics of some pathways in cells, emphasizing on differences between cancer
and normal cells. The methods we use include molecular dynamics simulation,
docking (please see movies of docking computation here) , computational systems biology,
and QSAR methods etc.
Here, a peptide
folding simulation movie, which was laboratory¡¦s ex-research topic, is hung as well: a movie of peptide
folding simulation!