Testing High-Level QM/MM Methods for Modeling Enzyme Reactions: Acetyl-CoA Deprotonation in Citrate Synthase (2010)

First Author: Van Der Kamp M
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/10.1021/jp104069t

PubMed Identifier: 20690673

Publication URI: http://europepmc.org/abstract/MED/20690673

Type: Journal Article/Review

Parent Publication: The Journal of Physical Chemistry B

Issue: 34

ISSN: 1520-5207