Computational studies of enzyme-catalyzed reactions: Where are we in predicting mechanisms and in understanding the nature of enzyme catalysis?

Journal of Physical Chemistry B

Volumn 106, Issue 7, 2002, Pages 1537-1542

  Kollman, Peter A ^a   Kuhn, Bernd ^a,b   Peräkylä, Mikael ^a,c  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b F HOFFMANN LA ROCHE LTD   (Switzerland)

^c UNIVERSITY OF EASTERN FINLAND   (Finland)

Author keywords

[No Author keywords available]

Indexed keywords

NONCOVALENT COMPLEXES;

ACTIVATION ENERGY; CARBOXYLATION; CATALYSIS; COMPUTER SIMULATION; ENTROPY; FREE ENERGY; MOLECULAR DYNAMICS; QUANTUM THEORY;

ENZYME KINETICS;

EID: 0037149081     PISSN: 10895647     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp012017p     Document Type: Review

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