Yohann Moreau
Affiliations: | Nancy 1 |
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"Yohann Moreau"Mean distance: (not calculated yet)
Parents
Sign in to add mentor| Xavier Assfeld | grad student | 2005 | Nancy 1 | |
| (Développement d'une méthode théorique pour l'étude de la réactivité chimique des systèmes moléculaires complexes en solution) | ||||
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Publications
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| David R, Jamet H, Niviere V, et al. (2017) Iron hydroperoxide intermediate in Superoxide Reductase: Protonation or Dissociation First? MM Dynamics and QM/MM Metadynamics study. Journal of Chemical Theory and Computation |
| Molle T, Moreau Y, Clémancey M, et al. (2016) Redox behavior of the SAM-binding Fe-S cluster in Methylthiotransferase RimO, towards under-standing dual SAM activity. Biochemistry |
| Dumont E, Grüber R, Bignon E, et al. (2015) Probing the reactivity of singlet oxygen with purines. Nucleic Acids Research |
| Tremey E, Bonnot F, Moreau Y, et al. (2013) Hydrogen bonding to the cysteine ligand of superoxide reductase: acid-base control of the reaction intermediates. Journal of Biological Inorganic Chemistry : Jbic : a Publication of the Society of Biological Inorganic Chemistry. 18: 815-30 |
| Bonnot F, Molle T, Ménage S, et al. (2012) Control of the evolution of iron peroxide intermediate in superoxide reductase from Desulfoarculus baarsii. Involvement of lysine 48 in protonation. Journal of the American Chemical Society. 134: 5120-30 |
| Raspail C, Graindorge M, Moreau Y, et al. (2011) 4-hydroxyphenylpyruvate dioxygenase catalysis: identification of catalytic residues and production of a hydroxylated intermediate shared with a structurally unrelated enzyme. The Journal of Biological Chemistry. 286: 26061-70 |
| Fornili A, Moreau Y, Sironi M, et al. (2006) On the suitability of strictly localized orbitals for hybrid QM/MM calculations. Journal of Computational Chemistry. 27: 515-23 |
| Moreau Y, Loos PF, Assfeld X. (2004) Solvent effects on the asymmetric Diels-Alder reaction between cyclopentadiene and (-)-menthyl acrylate revisited with the three-layer hybrid local self-consistent field/molecular mechanics/self-consistent reaction field method Theoretical Chemistry Accounts. 112: 228-239 |