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Comparison of Receptor-Ligand Restraint Schemes for Alchemical Absolute Binding Free Energy Calculations. (2023)

First Author: Clark F

Attributed to: Next generation atomistic modelling for medicinal chemistry and biology funded by UKRI FLF

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.3c00139

PubMed Identifier: 37285579

Publication URI: http://europepmc.org/abstract/MED/37285579

Type: Journal Article/Review

Volume: 19

Parent Publication: Journal of chemical theory and computation

Issue: 12

ISSN: 1549-9618