Accelerating QM/MM Free Energy Calculations:  Representing the Surroundings by an Updated Mean Charge Distribution

Title
Accelerating QM/MM Free Energy Calculations:  Representing the Surroundings by an Updated Mean Charge Distribution
Authors
Keywords
-
Journal
JOURNAL OF PHYSICAL CHEMISTRY B
Volume 112, Issue 18, Pages 5680-5692
Publisher
American Chemical Society (ACS)
Online
2008-04-16
DOI
10.1021/jp711496y

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