Structural Fluctuations in Enzyme-Catalyzed Reactions: Determinants of Reactivity in Fatty Acid Amide Hydrolase from Multivariate Statistical Analysis of Quantum Mechanics/Molecular Mechanics Paths. (2010)
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/10.1021/ct100264j
PubMed Identifier: 26616091
Publication URI: http://europepmc.org/abstract/MED/26616091
Type: Journal Article/Review
Volume: 6
Parent Publication: Journal of chemical theory and computation
Issue: 9
ISSN: 1549-9618