Bernard-Pierre Roques

Publication Activity (10 Years)

Years Active: 1983-2001
Publications (10 Years): 0

Publications

Gilles Tiraboschi, Marie-Claude Fournié-Zaluski, Bernard-Pierre Roques, Nohad Gresh
Intramolecular chelation of Zn2+ by - and -mercaptocarboxamides. A parallel ab initio and polarizable molecular mechanics investigation. Assessment of the role of multipole transferability. J. Comput. Chem. 22 (10) (2001)
Gilles Tiraboschi, Bernard-Pierre Roques, Nohad Gresh
Joint quantum chemical and polarizable molecular mechanics investigation of formate complexes with penta- and hexahydrated Zn2+: Comparison between energetics of model bidentate, monodentate, and through-water Zn2+ binding modes and evaluation of nonadditivity effects. J. Comput. Chem. 20 (13) (1999)
M. Kreissler, M. Pesquer, Bernard Maigret, Marie-Claude Fournié-Zaluski, Bernard-Pierre Roques
Computer simulation of the conformational behavior of cholecystokinin fragments: Conformational families of sulfated CCK8. J. Comput. Aided Mol. Des. 3 (1) (1989)
Serge Boiteux, Joël Belleney, Bernard-Pierre Roques, Jacques Laval
Two rotameric forms of open ring 7-methylguanine are present in alkylated polynucleotides. Nucleic Acids Res. 12 (13) (1984)
A. Delbarre, M. I. Gourevitch, B. Gaugain, J. B. Le Pecq, Bernard-Pierre Roques
1H NMR study of an ethidium dimer poly(dA-dT) complex: evidence of a transition between bis and monointercalation. Nucleic Acids Res. 11 (13) (1983)