François Ogliaro
Centre National de la Recherche Scientifique(FR)Laboratoire de Chimie Théorique(FR)Université de Lorraine(FR)University of Bologna(IT)
Publications by Year
Research Areas
Metal-Catalyzed Oxygenation Mechanisms, Metal complexes synthesis and properties, Organometallic Complex Synthesis and Catalysis, Advanced Chemical Physics Studies, Pharmacogenetics and Drug Metabolism
Most-Cited Works
- → A Model “Rebound” Mechanism of Hydroxylation by Cytochrome P450: Stepwise and Effectively Concerted Pathways, and Their Reactivity Patterns(2000)392 cited
- → Two-state reactivity mechanisms of hydroxylation and epoxidation by cytochrome P-450 revealed by theory(2002)356 cited
- → The Elusive Oxidant Species of Cytochrome P450 Enzymes: Characterization by Combined Quantum Mechanical/Molecular Mechanical (QM/MM) Calculations(2002)313 cited
- → 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(2002)304 cited
- → What Factors Affect the Regioselectivity of Oxidation by Cytochrome P450? A DFT Study of Allylic Hydroxylation and Double Bond Epoxidation in a Model Reaction(2002)302 cited
- → Multi-State Epoxidation of Ethene by Cytochrome P450: A Quantum Chemical Study(2001)236 cited