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A QM/MM study of a nucleophilic aromatic substitution reaction catalyzed by 4-chlorobenzoyl-CoA dehalogenase

Dingguo Xu,a   Hua Guo,*a   Jiali Gaob and   Qiang Cuic  
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a
Department of Chemistry, University of New Mexico, Albuquerque, USA
E-mail: hguo@unm.edu;
Fax: 01 505 277 2609 ;
Tel: 01 505 277 1716
b
Department of Chemistry, University of Minnesota, Minneapolis, USA
c
Department of Chemistry, University of Wisconsin, Madison, USA
Chem. Commun., 2004, 892-893

DOI: 10.1039/B401159G
Received 26 Jan 2004, Accepted 20 Feb 2004
First published online 05 Mar 2004
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