Carme Rovira
Centre de Recerca en Química Teorica
Parc Científic de Barcelona
Josep Samitier 1-5
08028 Barcelona
Spain
Name/email consistency: high
- First principles study of coenzyme B12. Crystal packing forces effect on axial bond lengths. Rovira, C., Kozlowski, P.M. J. Phys. Chem. B (2007)
- Structure, protonation state and dynamics of catalase compound II. Rovira, C. Chemphyschem (2005)
- Structure-energy relations in methylcobalamin with and without bound axial base. Rovira, C., Biarnés, X., Kunc, K. Inorg. Chem (2004)
- Protonation state of the equatorial ligands and dynamics of the OH...O units in a cobaloxime biomimetic. Rovira, C., Kunc, K., Parrinello, M. Inorg. Chem (2002)