Free energies of binding from large-scale density functional theory

被引：0
作者：
Skylaris, Chris-Kriton
Fox, Stephen
Pittock, Chris
Essex, Jonathan W.
Fox, Thomas
Tautermann, Christofer
Malcolm, Noj
机构：
[1] Univ Southampton, Southampton, Hants, England
[2] Boehringer Ingelheim GmbH & Co KG, Lead Identificat & Optimizat, Ingelheim, Germany
[3] Accelrys Ltd, Cambridge, England
来源：
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY | 2011年 / 241卷
关键词：
D O I：
暂无
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
50-COMP
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页数：1
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    [J]. JOURNAL OF CHEMICAL PHYSICS, 2008, 128 (01)
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