Fast and Accurate Calculation of Small Molecule Solvation Free Energies using Replica Exchange Accelerated Molecular Dynamics

被引：0
|
作者：
Arrar, Mehrnoosh [1 ]
Sinko, William [1 ]
Fajer, Mikolai [1 ]
Agusto, Cesar [1 ]
de Oliveira, F. [1 ]
McCammon, J. Andrew [1 ]
机构：
[1] Univ Calif San Diego, San Diego, CA USA
来源：
BIOPHYSICAL JOURNAL | 2012年 / 102卷 / 03期
关键词：
D O I：
10.1016/j.bpj.2011.11.2450
中图分类号：
Q6 [生物物理学];
学科分类号：
071011 ;
摘要：
引用
收藏
页码：447A / 447A
页数：1
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