Jérémy Desaphy

sc-PDB: a 3D-database of ligandable binding sites—10 years on

Jérémy Desaphy, Guillaume Bret, Didier Rognan et al. · Nucleic Acids Research · 2014 · 305 citations · Full text

Unique Ligands, Molecular Biology, Binding Site +16

Comparison and Druggability Prediction of Protein–Ligand Binding Sites from Pharmacophore-Annotated Cavity Shapes

Jérémy Desaphy, Karima Azdimousa, Esther Kellenberger et al. · Journal of Chemical Information and Modeling · 2012 · 164 citations

Encoding Protein–Ligand Interaction Patterns in Fingerprints and Graphs

Jérémy Desaphy, Eric Raimbaud, Pierre Ducrot et al. · Journal of Chemical Information and Modeling · 2013 · 164 citations

Molecular Biology, Chemical Biology, Biological Network +16

Beware of Machine Learning-Based Scoring Functions—On the Danger of Developing Black Boxes

Joffrey Gabel, Jérémy Desaphy, Didier Rognan · Journal of Chemical Information and Modeling · 2014 · 145 citations

IChem: A Versatile Toolkit for Detecting, Comparing, and Predicting Protein–Ligand Interactions

Franck Da Silva, Jérémy Desaphy, Didier Rognan · ChemMedChem · 2017 · 107 citations · Full text

Molecular Biology, Computational Chemistry, Versatile Toolkit +22