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Francios Ogliaro, Ph. D

Affiliations: 
Chemistry Hebrew University, Jerusalem, Jerusalem, Israel 
Area:
Computational Chemistry
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"Francios Ogliaro"
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Sason S. Shaik post-doc 1999-2002 Hebrew University

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Shaik S, Cohen S, de Visser S, et al. (2004) The“Rebound Controversy”: An Overview and Theoretical Modeling of the Rebound Step in C−H Hydroxylation by Cytochrome P450 European Journal of Inorganic Chemistry. 2004: 207-226
Shaik S, Cohen S, de Visser SP, et al. (2004) The “Rebound Controversy”: An Overview and Theoretical Modeling of the Rebound Step in C—H Hydroxylation by Cytochrome P450 Cheminform. 35
Shaik S, Cohen S, De Visser SP, et al. (2004) The "Rebound Controversy": An Overview and Theoretical Modeling of the Rebound Step in C-H Hydroxylation by Cytochrome P450 European Journal of Inorganic Chemistry. 207-226
Sharma PK, De Visser SP, Ogliaro F, et al. (2003) Is the ruthenium analogue of compound I of cytochrome P450 an efficient oxidant? A theoretical investigation of the methane hydroxylation reaction Journal of the American Chemical Society. 125: 2291-2300
De Visser SP, Ogliaro F, Sharma PK, et al. (2002) Hydrogen bonding modulates the selectivity of enzymatic oxidation by P450: Chameleon oxidant behavior by compound I Angewandte Chemie - International Edition. 41: 1947-1951
Shaik S, De Visser SP, Ogliaro F, et al. (2002) Two-state reactivity mechanisms of hydroxylation and epoxidation by cytochrome P-450 revealed by theory Current Opinion in Chemical Biology. 6: 556-567
De Visser SP, Ogliaro F, Sharma PK, et al. (2002) What factors affect the regioselectivity of oxidation by cytochrome P450? A DFT study of allylic hydroxylation and double bond epoxidation in a model reaction Journal of the American Chemical Society. 124: 11809-11826
Ogliaro F, De Visser SP, Shaik S. (2002) The 'push' effect of the thiolate ligand in cytochrome P450: A theoretical gauging Journal of Inorganic Biochemistry. 91: 554-567
Schöneboom JC, Lin H, Reuter N, et al. (2002) The elusive oxidant species of cytochrome P450 enzymes: Characterization by combined quantum mechanical/molecular mechanical (QM/MM) calculations Journal of the American Chemical Society. 124: 8142-8151
Ogliaro F, De Visser SP, Cohen S, et al. (2002) Searching for the second oxidant in the catalytic cycle of cytochrome P450: A theoretical investigation of the iron(III)-hydroperoxo species and its epoxidation pathways Journal of the American Chemical Society. 124: 2806-2817
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