Approaches for calculating solvation free energies and enthalpies demonstrated with an update of the FreeSolv database. (2017)

First Author: Matos GDR
Attributed to:  Adaptive Multi-Resolution Massively-Multicore Hybrid Dynamics funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jced.7b00104

PubMed Identifier: 29056756

Publication URI: http://europepmc.org/abstract/MED/29056756

Type: Journal Article/Review

Volume: 62

Parent Publication: Journal of chemical and engineering data

Issue: 5

ISSN: 0021-9568