Predicting ADMET properties from molecule SMILE: a bottom-up approach using attention-based Graph Neural Networks
Articolo
Data di Pubblicazione:
2024
Tipologia CRIS:
1.1 Articolo in rivista
Keywords:
Mathematical modeling, Pharmacometrics, Pharmacokinetics, ADMET, drug development, Artificial Intelligence techniques, graph neural network, attention-based architecture
Elenco autori:
De Carlo, A.; Ronchi, D.; Piastra, M.; Tosca, E. M.; Magni, P.
Link alla scheda completa:
Pubblicato in: