Free energies of binding from large-scale first-principles quantum mechanical calculations: application to ligand hydration energies. (2013)
Attributed to:
A platform for future development and application of the ONETEP software
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1021/jp404518r
PubMed Identifier: 23841453
Publication URI: http://europepmc.org/abstract/MED/23841453
Type: Journal Article/Review
Volume: 117
Parent Publication: The journal of physical chemistry. B
Issue: 32
ISSN: 1520-5207