Adopted FY2005 Shuji OGATA Atushi OSHIYAMA Masaki SATOH Toshikazu TAKADA Keiko TAKAHASHI Seiichiro TEN-NO Kimihiko HIRAO Mitsuhiro MATSU'URA Adopted FY2006 Masataka NAGAOKA Hiroyasu HASUMI Masahiko MACHIDA Masuhiro MIKAMI Keiji MOROKUMA Yasuhiro YAMANAKA Ryoichi YAMAMOTO Adopted FY2007 Yuriko AOKI Masatoshi IMADA Hideyuki USUI Akio KITAO Hiroshi NAKATSUJI Shinobu YOSHIMURA |
Research Directors / Research Themes Highly accurate Order(N) computational method for gigantic systems and material design for nano-bio systems
We aim to construct the integrated simulation system for the prediction of biomolecular complexes and the analysis of their functional mechanisms. This novel simulation method gradually shifts from coarse-grained models to the finer-grained ones, selecting more possible candidates from a large number of model complex structures and then accessing a small number of candidates accurately. Thus we intend to realize effective and accurate modeling of protein-ligand and protein-protein interactions.
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