GraphEGFR Multi-task and transfer learning based on molecular graph attention mechanism and fingerprints improving inhibitor bioactivity prediction for EGFR family proteins on data scarcity

GraphEGFR : Multi-task and transfer learning based on molecular graph attention mechanism and fingerprints improving inhibitor bioactivity prediction for EGFR family proteins on data scarcity

© 2024 Wiley Periodicals LLC.

Détails bibliographiques
Publié dans:Journal of computational chemistry. - 1984. - 45(2024), 23 vom: 05. Sept., Seite 2001-2023
Auteur principal: Boonyarit, Bundit (Auteur)
Autres auteurs: Yamprasert, Nattawin, Kaewnuratchadasorn, Pawit, Kinchagawat, Jiramet, Prommin, Chanatkran, Rungrotmongkol, Thanyada, Nutanong, Sarana
Format: Article en ligne
Langue:English
Publié: 2024
Accès à la collection:Journal of computational chemistry
Sujets:Journal Article drug discovery epidermal growth factor receptor graph attention mechanism multi‐task learning transfer learning ErbB Receptors EC 2.7.10.1 Protein Kinase Inhibitors EGFR protein, human
Accès en ligne Volltext