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Physical Chemistry Chemical Physics

High quality research in physical chemistry, chemical physics and biophysical chemistry.


Predictive methods for computational metalloenzyme redesign – a test case with carboxypeptidase A

Corresponding authors
Department of Chemistry and Biochemistry, University of California, Los Angeles, Los Angeles, USA
E-mail: ana@chem.ucla.edu
Molecular Theory Group, Colorado School of Mines, Golden, USA
E-mail: meberhar@mines.edu
California NanoSystems Institute, Los Angeles, USA
Phys. Chem. Chem. Phys., 2016,18, 31744-31756

DOI: 10.1039/C6CP02247B
Received 05 Apr 2016, Accepted 22 Sep 2016
First published online 22 Sep 2016
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Supplementary Info