Accuracy Test of the OPLS-AA Force Field for Calculating Free Energies of Mixing and Comparison with PAC-MAC

Published 2017 View Full Article

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Title
Accuracy Test of the OPLS-AA Force Field for Calculating Free Energies of Mixing and Comparison with PAC-MAC
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 13, Issue 5, Pages 1911-1923
Publisher
American Chemical Society (ACS)
Online
2017-04-19
DOI
10.1021/acs.jctc.6b01106

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