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QM/MM simulations predict a covalent intermediate in the hen egg white lysozyme reaction with its natural substrate. (2008)

First Author: Bowman AL

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/10.1039/b810099c

PubMed Identifier: 18802578

Publication URI: http://europepmc.org/abstract/MED/18802578

Type: Journal Article/Review

Parent Publication: Chemical communications (Cambridge, England)

Issue: 37

ISSN: 1359-7345