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Ligand Binding Free Energies with Adaptive Water Networks: Two-Dimensional Grand Canonical Alchemical Perturbations. (2018)

First Author: Bruce Macdonald HE

Attributed to: CCP-BioSim: Biomolecular simulation at the life sciences interface funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.8b00614

PubMed Identifier: 30451501

Publication URI: http://europepmc.org/abstract/MED/30451501

Type: Journal Article/Review

Volume: 14

Parent Publication: Journal of chemical theory and computation

Issue: 12

ISSN: 1549-9618