Rchr

J-GLOBAL ID：200901008084244375 Update date: May. 18, 2020

Kitaura Kazuo

キタウラカズオ | Kitaura Kazuo

Affiliation and department：
Homepage URL (1)： http://www.aist.go.jp/RESEARCHERDB/cgi-bin/worker_detail.cgi?call=namae&rw_id=K71015682

Research field (1)： Basic physical chemistry

Research keywords (1)：分子軌道法分子間相互作用電子状態計算構造-機能相関

MISC (19)：

DG Fedorov, K Kitaura, H Li, JH Jensen, MS Gordon. The polarizable continuum model (PCM) interfaced with the fragment molecular orbital method (FMO). JOURNAL OF COMPUTATIONAL CHEMISTRY. 2006. 27. 8. 976-985
T Ishida, DG Fedorov, K Kitaura. All electron quantum chemical calculation of the entire enzyme system confirms a collective catalytic device in the chorismate mutase reaction. JOURNAL OF PHYSICAL CHEMISTRY B. 2006. 110. 3. 1457-1463
T Nemoto, DG Fedorov, M Uebayasi, K Kanazawa, K Kitaura, Y Komeiji. Ab initio fragment molecular orbital (FMO) method applied to analysis of the ligand-protein interaction in a pheromone-binding protein. COMPUTATIONAL BIOLOGY AND CHEMISTRY. 2005. 29. 6. 434-439
DG Fedorov, K Kitaura. Coupled-cluster theory based upon the fragment molecular-orbital method. JOURNAL OF CHEMICAL PHYSICS. 2005. 123. 13. 134103_1-134103_11
Y Mochizuki, K Fukuzawa, A Kato, S Tanaka, K Kitaura, T Nakano. 1A configuration analysis for fragment interaction. CHEMICAL PHYSICS LETTERS. 2005. 410. 4-6. 247-253

ｍore...

Association Membership(s) (4)：

アメリカ化学会 , 近畿化学協会 , 日本薬学会 , 日本化学会

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