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List of works by Jérémy Desaphy

Beware of machine learning-based scoring functions-on the danger of developing black boxes

scientific article

Comparison and druggability prediction of protein-ligand binding sites from pharmacophore-annotated cavity shapes

scientific article published on 16 August 2012

Do Fragments and Crystallization Additives Bind Similarly to Drug-like Ligands?

scientific article published on 17 April 2017

Encoding protein-ligand interaction patterns in fingerprints and graphs

scientific article published on 6 March 2013

Structural insights into the molecular basis of the ligand promiscuity

scientific article published on 5 September 2012

sc-PDB-Frag: a database of protein-ligand interaction patterns for Bioisosteric replacements

scientific article published on 17 July 2014

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

scientific article

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