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Results: 1-17 |
Results: 17

Authors: Danovich, D Ogliaro, F Karni, M Apeloig, Y Cooper, DL Shaik, S
Citation: D. Danovich et al., Silynes (RC equivalent to SiR ') and disilynes (RSi equivalent to SiR '): Why are less bonds worth energetically more?, ANGEW CHEM, 40(21), 2001, pp. 4023

Authors: Groves, JT Shaik, S Ogliaro, F De Visser, SP
Citation: Jt. Groves et al., Chameleon states: High-valent metal-oxo species of cytochrome P450 and itsruthenium analogue (vol 40, pg 2874, 2001), ANGEW CHEM, 40(19), 2001, pp. 3503-3503

Authors: de Visser, SP Ogliaro, F Shaik, S
Citation: Sp. De Visser et al., How does ethene inactivate cytochrome P450 En Route to its epoxidation? A density functional study, ANGEW CHEM, 40(15), 2001, pp. 2871-2874

Authors: Ogliaro, F de Visser, SP Groves, JT Shaik, S
Citation: F. Ogliaro et al., Chameleon states: High-valent metal-oxo species of cytochrome P450 and itsruthenium analogue, ANGEW CHEM, 40(15), 2001, pp. 2874-2878

Authors: de Visser, SP Ogliaro, F Sason, S
Citation: Sp. De Visser et al., Stereospecific oxidation by Compound I of Cytochrome P450 does not proceedin a concerted synchronous manner, CHEM COMMUN, (22), 2001, pp. 2322-2323

Authors: de Visser, SP Ogliaro, F Gross, Z Shaik, S
Citation: Sp. De Visser et al., What is the difference between the manganese porphyrin and corrole analogues of cytochrome P450's compound I?, CHEM-EUR J, 7(22), 2001, pp. 4954-4960

Authors: de Visser, SP Ogliaro, F Harris, N Shaik, S
Citation: Sp. De Visser et al., Multi-state epoxidation of ethene by cytochrome P450: A quantum chemical study, J AM CHEM S, 123(13), 2001, pp. 3037-3047

Authors: Ogliaro, F Filatov, M Shaik, S
Citation: F. Ogliaro et al., Alkane hydroxylation by cytochrome P450: Is kinetic isotope effect a reliable probe of transition state structure?, EUR J INORG, (12), 2000, pp. 2455-2458

Authors: Ogliaro, F Cohen, S Filatov, M Harris, N Shaik, S
Citation: F. Ogliaro et al., The high-valent compound of cytochrome P450: The nature of the Fe-S bond and the role of the thiolate ligand as an internal electron donor, ANGEW CHEM, 39(21), 2000, pp. 3851

Authors: Harris, N Cohen, S Filatov, M Ogliaro, F Shaik, S
Citation: N. Harris et al., Two-state reactivity in the rebound step of alkane hydroxylation by cytochrome P-450: Origins of free radicals with finite lifetimes, ANGEW CHEM, 39(11), 2000, pp. 2003

Authors: Ogliaro, F Halet, JF Astruc, D Saillard, JY
Citation: F. Ogliaro et al., A DFT investigation of the molecular and electronic structures of 19-electron transition-metal sandwich complexes, NEW J CHEM, 24(5), 2000, pp. 257-259

Authors: Ogliaro, F Loades, SD Cooper, DL Karadakov, PB
Citation: F. Ogliaro et al., Spin-coupled model of the bonding in first-row transition metal methylene monocations, J PHYS CH A, 104(30), 2000, pp. 7091-7098

Authors: Ogliaro, F Cohen, S de Visser, SP Shaik, S
Citation: F. Ogliaro et al., Medium polarization and hydrogen bonding effects on compound I of Cytochrome p450: What kind of a radical is it really?, J AM CHEM S, 122(51), 2000, pp. 12892-12893

Authors: Ogliaro, F Harris, N Cohen, S Filatov, M de Visser, SP Shaik, S
Citation: F. Ogliaro et al., A model "rebound" mechanism of hydroxylation by cytochrome P450: Stepwise and effectively concerted pathways, and their reactivity patterns, J AM CHEM S, 122(37), 2000, pp. 8977-8989

Authors: Gautier, R Ogliaro, F Halet, JF Saillard, JY Baerends, EJ
Citation: R. Gautier et al., Bonding analysis in inorganic transition-metal cubic clusters, 5 - M-8(mu(8)-E ')(mu(4)-E)(6)L-8 species centered and hexacapped by main-group atoms, EUR J INORG, (7), 1999, pp. 1161-1168

Authors: Ogliaro, F Cooper, DL Karadakov, PB
Citation: F. Ogliaro et al., Bent-bond versus separated-bond models: A spin-coupled survey for a few organic and inorganic systems, INT J QUANT, 74(2), 1999, pp. 223-229

Authors: Ogliaro, F Cordier, S Halet, JF Perrin, C Saillard, JY Sergent, M
Citation: F. Ogliaro et al., Detailed structural and theoretical studies of the bonding in edge-bridgedhalide and oxyhalide octahedral niobium and tantalum clusters, INORG CHEM, 37(24), 1998, pp. 6199-6207
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