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Publications from using the Service

R. Latifi, J. S. Valentine, W. Nam and S. P. de Visser, "Predictive studies of H-atom abstraction reactions by an iron(IV)-oxo corrole cation radical oxidant", Chem. Commun., 48, 3491-3493, 2012.

R. Latifi, L. Tahsini, W. Nam and S. P. de Visser, "Regioselectivity of aliphatic versus aromatic hydroxylation by a nonheme iron(II)-superoxo complex", Phys. Chem. Chem. Phys., 14, 2518-2524, 2012.

D. Kumar, G. N. Sastry and S. P. de Visser, "Axial ligand effect on the rate constant of aromatic hydroxylation by iron(IV)-oxo complexes mimicking cytochrome P450 enzymes", J. Phys. Chem. B, 116, 718-730, 2012.

D. Kumar, G. N. Sastry, D. P. Goldberg and S. P. de Visser, "Mechanism of S-oxygenation by a cysteine dioxygenase model complex", J. Phys. Chem. A, 116, 582-591, 2012.

G. de Luca, J. W. Emsley, A. Lesage and D. Merlet, "The structure and conformations of mesogenic molecules in the pre-transitional region of the isotropic phase: 5OCB and MBBA and their mixture", Liq. Cryst., 39, 211-219, 2012.

S. Beccaceci, N. Armata, J. S. Ogden, J. M. Dyke, L. Rhyman and P. Ramasami, "A study of the atmospherically important reactions of dimethylsulfide (DMS) with I-2 and ICl using infrared matrix isolation spectroscopy and electronic structure calculations", Phys. Chem. Chem. Phys., 14, 2399-2407, 2012.

R. J. Baker, P. E. Colavita, D. M. Murphy, J. A. Platts and J. D. Wallis, "Fluorine-Fluorine Interactions in the Solid State: An Experimental and Theoretical Study", J. Phys. Chem. B, 116, 1435-1444, 2012.

C. Domene and S. Furini, "Molecular Dynamics Simulations of the TrkH Membrane Protein", Biochemistry, 51, 1559-1565, 2012.

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