Multireference Ab Initio Quantum Mechanics/Molecular...

Multireference Ab Initio Quantum Mechanics/Molecular Mechanics Study on Intermediates in the Catalytic Cycle of Cytochrome P450 cam†

Altun, Ahmet, Kumar, Devesh, Neese, Frank, Thiel, Walter
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Volume:
112
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp802092w
Date:
December, 2008
File:
PDF, 822 KB
english, 2008
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