Papyrus: a large-scale curated dataset aimed at bioactivity predictions. - Olivier J. M. Béquignon; Brandon J. Bongers; Willem Jespers; Adriaan P. IJzerman; B. van der Water; Gerard J. P. van Westen (J. Cheminformatics, 2023)

DrugEx: Deep Learning Models and Tools for Exploration of Drug-Like Chemical Space. - Martin Sícho; Sohvi Luukkonen; Helle W. van den Maagdenberg; Linde Schoenmaker; Olivier J. M. Béquignon; Gerard J. P. van Westen (J. Chem. Inf. Model., 2023)

Collaborative SAR Modeling and Prospective In Vitro Validation of Oxidative Stress Activation in Human HepG2 Cells. - Olivier J. M. Béquignon; Jose C. Gómez-Tamayo; Eelke B. Lenselink; Steven Wink; Steven Hiemstra; Chi Chung Lam; Domenico Gadaleta; Alessandra Roncaglioni; Ulf Norinder; Bob van de Water; Manuel Pastor; Gerard J. P. van Westen (J. Chem. Inf. Model., 2023)

UnCorrupt SMILES: a novel approach to de novo design. - Linde Schoenmaker; Olivier J. M. Béquignon; Willem Jespers; Gerard J. P. van Westen (J. Cheminformatics, 2023)

QSPRpred: a Flexible Open-Source Quantitative Structure-Property Relationship Modelling Tool. - Helle W. van den Maagdenberg; Martin Sícho; David Alencar Araripe; Sohvi Luukkonen; Linde Schoenmaker; Michiel Jespers; Olivier J. M. Béquignon; Marina Gorostiola González; Remco L. van den Broek; Andrius Bernatavicius; J. G. Coen van Hasselt; Piet H. Van Der Graaf; et al. (J. Cheminformatics, 2024)