Small Molecule Solvation Free Energy: Enhanced Conformational Sampling Using Expanded Ensemble Molecular Dynamics Simulation

Published 2011 View Full Article

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Title
Small Molecule Solvation Free Energy: Enhanced Conformational Sampling Using Expanded Ensemble Molecular Dynamics Simulation
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 7, Issue 9, Pages 2910-2918
Publisher
American Chemical Society (ACS)
Online
2011-07-27
DOI
10.1021/ct200377w

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