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Identification of Optimal Ligand Growth Vectors Using an Alchemical Free-Energy Method. (2020)

First Author: Wade AD

Attributed to: Peta-5: A National Facility for Petascale Data Intensive Computation and Analytics funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jcim.0c00610

PubMed Identifier: 32810401

Publication URI: http://europepmc.org/abstract/MED/32810401

Type: Journal Article/Review

Volume: 60

Parent Publication: Journal of chemical information and modeling

Issue: 11

ISSN: 1549-9596