Analysis of polarization in QM/MM modelling of biologically relevant hydrogen bonds. (2008)
Attributed to:
Combined quantum mechanics/molecular mechanics (QM/MM) Monte Carlo free energy simulations: a feasibility study
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1098/rsif.2008.0243.focus
PubMed Identifier: 18782723
Publication URI: http://europepmc.org/abstract/MED/18782723
Type: Journal Article/Review
Volume: 5 Suppl 3
Parent Publication: Journal of the Royal Society, Interface
Issue: Suppl 3
ISSN: 1742-5662