Jean-Yves Le Questel

Publication Activity (10 Years)

Years Active: 2012-2024
Publications (10 Years): 4

Top Topics

Image Recognition

Molecular Dynamics

Top Venues

J. Chem. Inf. Model.

J. Comput. Chem.

J. Comput. Aided Mol. Des.

Publications

Zakaria Bouchouireb, Steeve H. Thany, Jean-Yves Le Questel
Development of CHARMM compatible force field parameters and molecular dynamics simulations for the pesticide flupyradifurone. J. Comput. Chem. 45 (7) (2024)
Zakaria Alamiddine, Balaji Selvam, Jérôme Graton, Adèle D. Laurent, Elodie Landagaray, Jacques Lebreton, Monique Mathé-Allainmat, Steeve H. Thany, Jean-Yves Le Questel
Binding of Sulfoxaflor to Aplysia californica-AChBP: Computational Insights from Multiscale Approaches. J. Chem. Inf. Model. 59 (9) (2019)
Jérôme Graton, Jean-Yves Le Questel, Peter Maxwell, Paul L. A. Popelier
Hydrogen-Bond Accepting Properties of New Heteroaromatic Ring Chemical Motifs: A Theoretical Study. J. Chem. Inf. Model. 56 (2) (2016)
Zakaria Alamiddine, Balaji Selvam, José Pedro Cerón-Carrasco, Monique Mathé-Allainmat, Jacques Lebreton, Steeve H. Thany, Adèle D. Laurent, Jérôme Graton, Jean-Yves Le Questel
Molecular recognition of thiaclopride by Aplysia californica AChBP: new insights from a computational investigation. J. Comput. Aided Mol. Des. 29 (12) (2015)
Nicolas Galland, Soleymane Kone, Jean-Yves Le Questel
Mapping of the interaction sites of galanthamine: a quantitative analysis through pairwise potentials and quantum chemistry. J. Comput. Aided Mol. Des. 26 (10) (2012)