Energy Decomposition Analysis Based on Absolutely Localized Molecular Orbitals for Large-Scale Density Functional Theory Calculations in Drug Design. (2016)
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/acs.jctc.6b00272
PubMed Identifier: 27248370
Publication URI: http://europepmc.org/abstract/MED/27248370
Type: Journal Article/Review
Volume: 12
Parent Publication: Journal of chemical theory and computation
Issue: 7
ISSN: 1549-9618