Rapid, Accurate, Precise, and Reliable Relative Free Energy Prediction Using Ensemble Based Thermodynamic Integration (2016)

First Author: Bhati A
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.6b00979

PubMed Identifier: 27997169

Publication URI: http://europepmc.org/abstract/MED/27997169

Type: Journal Article/Review

Parent Publication: Journal of Chemical Theory and Computation

Issue: 1

ISSN: 1549-9618