Ligand Binding Free Energies with Adaptive Water Networks: Two-Dimensional Grand Canonical Alchemical Perturbations

Published 2018 View Full Article

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Title
Ligand Binding Free Energies with Adaptive Water Networks: Two-Dimensional Grand Canonical Alchemical Perturbations
Authors
Keywords
-
Journal
Journal of Chemical Theory and Computation
Volume 14, Issue 12, Pages 6586-6597
Publisher
American Chemical Society (ACS)
Online
2018-11-20
DOI
10.1021/acs.jctc.8b00614

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