Development of a Robust Indirect Approach for MM → QM Free Energy Calculations That Combines Force-Matched Reference Potential and Bennett’s Acceptance Ratio Methods

Title
Development of a Robust Indirect Approach for MM → QM Free Energy Calculations That Combines Force-Matched Reference Potential and Bennett’s Acceptance Ratio Methods
Authors
Keywords
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Journal
Journal of Chemical Theory and Computation
Volume 15, Issue 10, Pages 5543-5562
Publisher
American Chemical Society (ACS)
Online
2019-09-11
DOI
10.1021/acs.jctc.9b00401

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