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Sensitivity of Binding Free Energy Calculations to Initial Protein Crystal Structure. (2021)

First Author: Suruzhon M

Attributed to: Solving the sampling problem in molecular simulations by Sequential Monte Carlo funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.0c00972

PubMed Identifier: 33534995

Publication URI: http://europepmc.org/abstract/MED/33534995

Type: Journal Article/Review

Volume: 17

Parent Publication: Journal of chemical theory and computation

Issue: 3

ISSN: 1549-9618