Large Scale Study of Ligand-Protein Relative Binding Free Energy Calculations: Actionable Predictions from Statistically Robust Protocols. (2022)

First Author: Bhati AP
Attributed to:  MICA: Medical Bioinformatics: Data-Driven Discovery for Personalised Medicine funded by MRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.1c01288

PubMed Identifier: 35293737

Publication URI: http://europepmc.org/abstract/MED/35293737

Type: Journal Article/Review

Volume: 18

Parent Publication: Journal of chemical theory and computation

Issue: 4

ISSN: 1549-9618