Molecular Design Based on 3D Pharmacophores. Applications to 5-HT7 Receptors. - Alban Lepailleur; Ronan Bureau; Stéphane Lemaître; François Dauphin; Jean-Charles Lancelot; Vincent Contesse; Sébastien Lenglet; Catherine Delarue; Hubert Vaudry; Sylvain Rault (J. Chem. Inf. Model., 2004)

Molecular Modeling Studies Focused on 5-HT7 versus 5-HT1A Selectivity. Discovery of Novel Phenylpyrrole Derivatives with High Affinity for 5-HT7 Receptors. - Alban Lepailleur; Ronan Bureau; Magalie Paillet-Loilier; Frédéric Fabis; Nicolas Saettel; Stéphane Lemaître; François Dauphin; Aurélien Lesnard; Jean-Charles Lancelot; Sylvain Rault (J. Chem. Inf. Model., 2005)

Receptor- and Ligand-Based Study on Novel 2, 2′-Bithienyl Derivatives as Non-Peptidic AANAT Inhibitors. - Alban Lepailleur; Stéphane Lemaître; Xiao Feng; Jana Sopkova-de Oliveira Santos; Philippe Delagrange; Jean Boutin; Pierre Renard; Ronan Bureau; Sylvain Rault (J. Chem. Inf. Model., 2010)

Introduction of Jumping Fragments in Combination with QSARs for the Assessment of Classification in Ecotoxicology. - Sylvain Lozano; Guillaume Poezevara; Marie-Pierre Halm-Lemeille; Elodie Lescot-Fontaine; Alban Lepailleur; Ryan Bissell-Siders; Bruno Crémilleux; Sylvain Rault; Bertrand Cuissart; Ronan Bureau (J. Chem. Inf. Model., 2010)

Emerging Patterns as Structural Alerts for Computational Toxicology. - Bertrand Cuissart; Guillaume Poezevara; Bruno Crémilleux; Alban Lepailleur; Ronan Bureau (Contrast Data Mining, 2013)

Découverte des soft-skypatterns avec une approche PPC. - Willy Ugarte; Patrice Boizumault; Samir Loudni; Bruno Crémilleux; Alban Lepailleur (EGC, 2013)

Mining (Soft-) Skypatterns Using Constraint Programming. - Willy Ugarte; Patrice Boizumault; Samir Loudni; Bruno Crémilleux; Alban Lepailleur (EGC (best of volume), 2013)

Mining (Soft-) Skypatterns Using Dynamic CSP. - Willy Ugarte Rojas; Patrice Boizumault; Samir Loudni; Bruno Crémilleux; Alban Lepailleur (CPAIOR, 2014)

Dual Histamine H3R/Serotonin 5-HT4R Ligands with Antiamnesic Properties: Pharmacophore-Based Virtual Screening and Polypharmacology. - Alban Lepailleur; Thomas Freret; Stéphane Lemaître; Michel Boulouard; François Dauphin; Antoine Hinschberger; Fabienne Dulin; Aurélien Lesnard; Ronan Bureau; Sylvain Rault (J. Chem. Inf. Model., 2014)

Discovering Structural Alerts for Mutagenicity Using Stable Emerging Molecular Patterns. - Jean-Philippe Métivier; Alban Lepailleur; Aleksey Buzmakov 002; Guillaume Poezevara; Bruno Crémilleux; Sergei O. Kuznetsov; Jérémie Le Goff; Amedeo Napoli; Ronan Bureau; Bertrand Cuissart (J. Chem. Inf. Model., 2015)

Soft constraints for pattern mining. - Willy Ugarte; Patrice Boizumault; Samir Loudni; Bruno Crémilleux; Alban Lepailleur (J. Intell. Inf. Syst., 2015)

Skypattern mining: From pattern condensed representations to dynamic constraint satisfaction problems. - Willy Ugarte; Patrice Boizumault; Bruno Crémilleux; Alban Lepailleur; Samir Loudni; Marc Plantevit; Chedy Raïssi; Arnaud Soulet (Artif. Intell., 2017)

Conformation and Dynamics of Human Urotensin II and Urotensin Related Peptide in Aqueous Solution. - Elke Haensele; Nawel Mele; Marija Miljak; Christopher M. Read; David C. Whitley; Lee Banting; Carla Delépée; Jana Sopkova-de Oliveira Santos; Alban Lepailleur; Ronan Bureau; Jonathan W. Essex; Timothy Clark (J. Chem. Inf. Model., 2017)

Selecting Outstanding Patterns Based on Their Neighbourhood. - Etienne Lehembre; Ronan Bureau; Bruno Crémilleux; Bertrand Cuissart; Jean Luc Lamotte; Alban Lepailleur; Abdelkader Ouali; Albrecht Zimmermann (IDA, 2022)

Deciphering a Pharmacophore Network: A Case Study Using BCR-ABL Data. - Damien Geslin; Alban Lepailleur; Jean-Luc Manguin; Nhat-Vinh Vo; Jean Luc Lamotte; Bertrand Cuissart; Ronan Bureau (J. Chem. Inf. Model., 2022)

Towards a partial order graph for interactive pharmacophore exploration: extraction of pharmacophores activity delta. - Etienne Lehembre; Johanna Giovannini; Damien Geslin; Alban Lepailleur; Jean Luc Lamotte; David Auber; Abdelkader Ouali; Bruno Crémilleux; Albrecht Zimmermann; Bertrand Cuissart; Ronan Bureau (J. Cheminformatics, 2023)

Graph Neural Network Based on Molecular and Pharmacophoric Features for Drug Design Applications. - Mariana Azevedo; Luc Brun; Pierre Héroux; Jean Luc Lamotte; Ronan Bureau; Alban Lepailleur (GbRPR, 2025)