Perspective on free-energy perturbation calculations for chemical equilibria

被引：263

作者：

Jorgensen, William L. ^{[1
]}

Thomas, Laura L. ^{[1
]}

机构：

[1] Yale Univ, Dept Chem, New Haven, CT 06520 USA

来源：

JOURNAL OF CHEMICAL THEORY AND COMPUTATION | 2008年 / 4卷 / 06期

关键词：

D O I：

10.1021/ct800011m

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

[No abstract available]

引用

页码：869 / 876

页数：8

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