Alexandre Hocquet

An Evaluation of the MM+ Force Field

Alexandre Hocquet, Morten Langgård · Journal of Molecular Modeling · 1998 · 112 citations

Engineering, Mechanics, Mechanical Systems +4

Ground-State Properties of Nucleic Acid Constituents Studied by Density Functional Calculations. 3. Role of Sugar Puckering and Base Orientation on the Energetics and Geometry of 2‘-Deoxyribonucleosides and Ribonucleosides

Alexandre Hocquet, Nicolas Leulliot, Mahmoud Ghomi · The Journal of Physical Chemistry B · 2000 · 98 citations

Intramolecular hydrogen bonding in 2′-deoxyribonucleosides: an AIM topological study of the electronic density

Alexandre Hocquet · Physical Chemistry Chemical Physics · 2001 · 74 citations

Ligand field calculation of the lower electronic energy levels of the lanthanide monoxides

P. Carette, Alexandre Hocquet · Journal of Molecular Spectroscopy · 1988 · 71 citations

Inorganic Chemistry, Engineering, Lanthanide Monoxides +9

A conceptual DFT study of hydrazino peptides: Assessment of the nucleophilicity of the nitrogen atoms by means of the dual descriptor Δf(r)

Christophe Morell, Alexandre Hocquet, André Grand et al. · Journal of Molecular Structure THEOCHEM · 2007 · 56 citations

Dual Descriptor δF, Biochemistry, Hydrazino Peptides +6