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Journal of the American Chemical Society
|
October 5, 2006
QM/MM study of mechanisms for compound I formation in the catalytic cycle of cytochrome P450cam
Jingjing Zheng, Dongqi Wang, Walter Thiel, et al.
Journal of the American Chemical Society
|
August 24, 2006
Does substrate oxidation determine the regioselectivity of cyclohexene and propene oxidation by cytochrome p450?
Shimrit Cohen, Sebastian Kozuch, Carina Hazan, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
May 20, 2011
How can theory predict the selectivity of palladium-catalyzed cross-coupling of pristine aromatic molecules?
Rinat Meir, Sebastian Kozuch, Andreas Uhe, et al.
Angewandte Chemie (International Ed. in English)
|
May 9, 2012
Hydrogen-abstraction reactivity patterns from A to Y: the valence bond way
Wenzhen Lai, Chunsen Li, Hui Chen, et al.
Angewandte Chemie (International Ed. in English)
|
May 2, 2018
The Twin-Excited State as a Probe for the Transition State in Concerted Unimolecular Reactions: The Semibullvalene Rearrangement
Shmuel Zilberg, Yehuda Haas, David Danovich, et al.
Journal of Chemical Theory and Computation
|
November 25, 2015
Assessment of Theoretical Methods for Complexes of Gold(I) and Gold(III) with Unsaturated Aliphatic Hydrocarbon: Which Density Functional Should We Choose?
Runhua Kang, Hui Chen, Sason Shaik, et al.
Journal of Chemical Theory and Computation
|
November 21, 2015
On The Nature of the Halogen Bond
Changwei Wang, David Danovich, Yirong Mo, et al.
The Journal of Physical Chemistry. B
|
December 17, 2008
First half-reaction mechanism of nitric oxide synthase: the role of proton and oxygen coupled electron transfer in the reaction by quantum mechanics/molecular mechanics
Kyung-Bin Cho, Maria Angels Carvajal, Sason Shaik
Journal of the American Chemical Society
|
July 12, 2008
A valence bond modeling of trends in hydrogen abstraction barriers and transition states of hydroxylation reactions catalyzed by cytochrome P450 enzymes
Sason Shaik, Devesh Kumar, Sam P de Visser
Inorganic Chemistry
|
October 13, 2006
Catalysts for monooxygenations made from polyoxometalate: an iron(V)-oxo derivative of the Lindqvist anion
Etienne Derat, Devesh Kumar, Ronny Neumann, et al.
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of 31
Search research articles
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Showing results (111-120 of 310) with videos related to
Sort By:
Page
of 31
Journal of the American Chemical Society
|
October 5, 2006
QM/MM study of mechanisms for compound I formation in the catalytic cycle of cytochrome P450cam
Jingjing Zheng, Dongqi Wang, Walter Thiel, et al.
Journal of the American Chemical Society
|
August 24, 2006
Does substrate oxidation determine the regioselectivity of cyclohexene and propene oxidation by cytochrome p450?
Shimrit Cohen, Sebastian Kozuch, Carina Hazan, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
May 20, 2011
How can theory predict the selectivity of palladium-catalyzed cross-coupling of pristine aromatic molecules?
Rinat Meir, Sebastian Kozuch, Andreas Uhe, et al.
Angewandte Chemie (International Ed. in English)
|
May 9, 2012
Hydrogen-abstraction reactivity patterns from A to Y: the valence bond way
Wenzhen Lai, Chunsen Li, Hui Chen, et al.
Angewandte Chemie (International Ed. in English)
|
May 2, 2018
The Twin-Excited State as a Probe for the Transition State in Concerted Unimolecular Reactions: The Semibullvalene Rearrangement
Shmuel Zilberg, Yehuda Haas, David Danovich, et al.
Journal of Chemical Theory and Computation
|
November 25, 2015
Assessment of Theoretical Methods for Complexes of Gold(I) and Gold(III) with Unsaturated Aliphatic Hydrocarbon: Which Density Functional Should We Choose?
Runhua Kang, Hui Chen, Sason Shaik, et al.
Journal of Chemical Theory and Computation
|
November 21, 2015
On The Nature of the Halogen Bond
Changwei Wang, David Danovich, Yirong Mo, et al.
The Journal of Physical Chemistry. B
|
December 17, 2008
First half-reaction mechanism of nitric oxide synthase: the role of proton and oxygen coupled electron transfer in the reaction by quantum mechanics/molecular mechanics
Kyung-Bin Cho, Maria Angels Carvajal, Sason Shaik
Journal of the American Chemical Society
|
July 12, 2008
A valence bond modeling of trends in hydrogen abstraction barriers and transition states of hydroxylation reactions catalyzed by cytochrome P450 enzymes
Sason Shaik, Devesh Kumar, Sam P de Visser
Inorganic Chemistry
|
October 13, 2006
Catalysts for monooxygenations made from polyoxometalate: an iron(V)-oxo derivative of the Lindqvist anion
Etienne Derat, Devesh Kumar, Ronny Neumann, et al.
Page
of 31