I. Dissociation free energies of drug–receptor systems via non-equilibrium alchemical simulations: a theoretical framework
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Title
I. Dissociation free energies of drug–receptor systems via non-equilibrium alchemical simulations: a theoretical framework
Authors
Keywords
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Journal
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Volume 18, Issue 22, Pages 14991-15004
Publisher
Royal Society of Chemistry (RSC)
Online
2016-05-05
DOI
10.1039/c5cp05519a
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