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Improving molecular property prediction through a task similarity enhanced transfer learning strategy

Deeply understanding the properties (e.g., chemical or biological characteristics) of small molecules plays an essential role in drug development. A large number of molecular property datasets have been rapidly accumulated in recent years. However, most of these datasets contain only a limited amoun...

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Detalles Bibliográficos
Autores principales: Li, Han, Zhao, Xinyi, Li, Shuya, Wan, Fangping, Zhao, Dan, Zeng, Jianyang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9579493/
https://www.ncbi.nlm.nih.gov/pubmed/36274947
http://dx.doi.org/10.1016/j.isci.2022.105231

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