Using GNN property predictors as molecule generators. - Félix Therrien; Edward H. Sargent; Oleksandr Voznyy (CoRR, 2024)

A physics-based data-driven model for CO2 gas diffusion electrodes to drive automated laboratories. - Ivan Grega; Félix Therrien; Abhishek Soni; Karry Ocean; Kevan Dettelbach; Ribwar Ahmadi; Mehrdad Mokhtari; Curtis P. Berlinguette; Yoshua Bengio (CoRR, 2025)

OBELiX: A Curated Dataset of Crystal Structures and Experimentally Measured Ionic Conductivities for Lithium Solid-State Electrolytes. - Félix Therrien; Jamal Abou Haibeh; Divya Sharma; Rhiannon Hendley; Alex Hernández-García; Sun Sun; Alain Tchagang; Jiang Su; Samuel Huberman; Yoshua Bengio; Hongyu Guo; Homin Shin (CoRR, 2025)