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Enhancing QM/MM Molecular Dynamics Sampling in Explicit Environments via an Orthogonal-Space-Random-Walk-Based Strategy
Min, Donghong, Chen, Mengen, Zheng, Lianqing, Jin, Yonghao, Schwartz, Martin A., Sang, Qing-Xiang Amy, Yang, WeiVolume:
115
Language:
english
Journal:
The Journal of Physical Chemistry B
DOI:
10.1021/jp109454q
Date:
April, 2011
File:
PDF, 5.28 MB
english, 2011