| GraphSVX: Shapley Value Explanations for Graph Neural Networks A Duval, FD Malliaros ECML PKDD 2021, 2021 | 114 | 2021 |
| A Hitchhiker's Guide to Geometric GNNs for 3D Atomic Systems A Duval, SV Mathis, CK Joshi, V Schmidt, S Miret, FD Malliaros, T Cohen, ... arXiv preprint arXiv:2312.07511, 2023 | 59 | 2023 |
| Explainable artificial intelligence (XAI) A Duval MA4K9 Scholarly Report, Mathematics Institute, The University of Warwick 4, 2019 | 53 | 2019 |
| Faenet: Frame averaging equivariant gnn for materials modeling AA Duval, V Schmidt, A Hernández-Garcıa, S Miret, FD Malliaros, ... International Conference on Machine Learning, 9013-9033, 2023 | 45 | 2023 |
| Higher-order clustering and pooling for graph neural networks A Duval, F Malliaros Proceedings of the 31st ACM international conference on information …, 2022 | 40 | 2022 |
| Breaking Writer’s Block: Low-cost Fine-tuning of Natural Language Generation Models A Duval, T Lamson, GL de Kérouara, M Gallé EACL 2021, 2021 | 17 | 2021 |
| The representation selection problem: Why we should favor the geometric-module framework of spatial reorientation over the view-matching framework A Duval Cognition 192, 103985, 2019 | 14 | 2019 |
| Crystal-gfn: sampling crystals with desirable properties and constraints M AI4Science, A Hernandez-Garcia, A Duval, A Volokhova, Y Bengio, ... arXiv preprint arXiv:2310.04925, 2023 | 12* | 2023 |
| PhAST: Physics-aware, scalable, and task-specific GNNs for accelerated catalyst design A Duval, V Schmidt, S Miret, Y Bengio, A Hernández-García, D Rolnick | 9 | 2023 |
| Improving Molecular Modeling with Geometric GNNs: an Empirical Study A Ramlaoui, T Saulus, B Terver, V Schmidt, D Rolnick, FD Malliaros, ... arXiv preprint arXiv:2407.08313, 2024 | | 2024 |
| The Second Learning on Graphs Conference: Preface S Villar, B Chamberlain, Y Du, H St, CK Joshi, A Deac, I Duta, J Robinson, ... Learning on Graphs Conference, i-xix, 2024 | | 2024 |
| On the importance of catalyst-adsorbate 3D interactions for relaxed energy predictions A Carbonero, A Duval, V Schmidt, S Miret, A Hernandez-Garcia, Y Bengio, ... arXiv preprint arXiv:2310.06682, 2023 | | 2023 |
| Novel comprehension via dynamic social network of characters GL de Kérouara, A Duval | | 2020 |