Duval, Alexandre

4 publications

ICLRW 2025 LeMat-Bulk: Aggregating, and De-Duplicating Quantum Chemistry Materials Databases Martin Siron, Inel Djafar, Etienne du Fayet, Amandine Rossello, Ali Ramlaoui, Alexandre Duval

JMLR 2024 PhAST: Physics-Aware, Scalable, and Task-Specific GNNs for Accelerated Catalyst Design Alexandre Duval, Victor Schmidt, Santiago Miret, Yoshua Bengio, Alex Hernández-García, David Rolnick

LoG 2023 The Second Learning on Graphs Conference: Preface Soledad Villar, Benjamin Chamberlain, Yuanqi Du, Hannes St"ark, Chaitanya K. Joshi, Andreea Deac, Iulia Duta, Joshua Robinson, Yanqiao Zhu, Kexin Huang, Michelle Li, Sofia Bourhim, Ilia Igashov, Alexandre Duval, Mathieu Alain, Dominique Beaini, Xinyu Yuan

ECML-PKDD 2021 GraphSVX: Shapley Value Explanations for Graph Neural Networks Alexandre Duval, Fragkiskos D. Malliaros