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Computational modelling of oxygenation processes in enzymes and biomimetic model complexes

Sam P. de Visser,*a   Matthew G. Quesne,a   Bodo Martin,b   Peter Comba*b and   Ulf Ryde*c  
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a
Manchester Institute of Biotechnology and School of Chemical Engineering and Analytical Science, the University of Manchester, 131 Princess Street, Manchester M1 7DN, UK
E-mail: sam.devisser@manchester.ac.uk;
Fax: +44 (0)1613065201 ;
Tel: +44 (0)1613064882
b
Anorganisch-Chemisches Institut, Universität Heidelberg, Im Neuenheimer Feld 270, 69120 Heidelberg, Germany
E-mail: Peter.Comba@aci.uni-heidelberg.de;
Fax: +49 6221 546617 ;
Tel: +49 6221 548453
c
Department of Theoretical Chemistry, Lund University, Chemical Centre, P. O. Box 124, SE-221 00 Lund, Sweden
E-mail: Ulf.Ryde@teokem.lu.se;
Fax: +46 46 2228648 ;
Tel: +46 462224502
Chem. Commun., 2014,50, 262-282

DOI: 10.1039/C3CC47148A
Received 18 Sep 2013, Accepted 25 Oct 2013
First published online 29 Oct 2013

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