SwissParam 2023: a modern web-based tool for efficient small molecule parametrization M Bugnon, M Goullieux, UF Röhrig, MAS Perez, A Daina, O Michielin, ... Journal of Chemical Information and Modeling 63 (21), 6469-6475, 2023 | 34 | 2023 |
SwissDock 2024: major enhancements for small-molecule docking with Attracting Cavities and AutoDock Vina M Bugnon, UF Röhrig, M Goullieux, MAS Perez, A Daina, O Michielin, ... Nucleic Acids Research, gkae300, 2024 | 20 | 2024 |
Attracting cavities 2.0: improving the flexibility and robustness for small-molecule docking UF Röhrig, M Goullieux, M Bugnon, V Zoete Journal of Chemical Information and Modeling 63 (12), 3925-3940, 2023 | 11 | 2023 |
Predicting Antigen‐Specificities of Orphan T Cell Receptors from Cancer Patients with TCRpcDist MAS Perez, J Chiffelle, S Bobisse, F Mayol‐Rullan, M Bugnon, ... Advanced Science, 2405949, 2024 | | 2024 |
TCRfp: a new fingerprint-based approach for TCR repertoire analysis F Mayol-Rullan, M Bugnon, MAS Perez, V Zoete bioRxiv, 2023.12. 19.572261, 2023 | | 2023 |