Ab initio QM/MM modelling of acetyl-CoA deprotonation in the enzyme citrate synthase. (2007)
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/10.1016/j.jmgm.2007.04.002
PubMed Identifier: 17493853
Publication URI: http://europepmc.org/abstract/MED/17493853
Type: Journal Article/Review
Volume: 26
Parent Publication: Journal of molecular graphics & modelling
Issue: 3
ISSN: 1093-3263