“Molecular Anatomy”: a new multi-dimensional hierarchical scaffold analysis tool C Manelfi, M Gemei, C Talarico, C Cerchia, A Fava, F Lunghini, ... Journal of cheminformatics 13, 1-19, 2021 | 16 | 2021 |
The Spike Mutants website: a worldwide used resource against SARS-CoV-2 I Romeo, IG Prandi, E Giombini, CEM Gruber, D Pietrucci, S Borocci, ... International Journal of Molecular Sciences 23 (21), 13082, 2022 | 8 | 2022 |
ProfhEX: AI-based platform for small molecules liability profiling F Lunghini, A Fava, V Pisapia, F Sacco, D Iaconis, AR Beccari Journal of Cheminformatics 15 (1), 60, 2023 | 6 | 2023 |
MEDIATE-Molecular DockIng at homE: Turning collaborative simulations into therapeutic solutions G Vistoli, C Manelfi, C Talarico, A Fava, A Warshel, IV Tetko, R Apostolov, ... Expert Opinion on Drug Discovery 18 (8), 821-833, 2023 | 4 | 2023 |
“DompeKeys”: a set of novel substructure-based descriptors for efficient chemical space mapping, development and structural interpretation of machine learning models, and … C Manelfi, V Tazzari, F Lunghini, C Cerchia, A Fava, A Pedretti, ... Journal of Cheminformatics 16 (1), 21, 2024 | | 2024 |