A water-swap reaction coordinate for the calculation of absolute protein-ligand binding free energies. (2011)
Attributed to:
Multiscale Ensemble Computing for Modelling Biological Catalysts
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1063/1.3519057
PubMed Identifier: 21303099
Publication URI: http://europepmc.org/abstract/MED/21303099
Type: Journal Article/Review
Volume: 134
Parent Publication: The Journal of chemical physics
Issue: 5
ISSN: 0021-9606