A fingerprints based molecular property prediction method using the BERT model

Molecular property prediction (MPP) is vital in drug discovery and drug reposition. Deep learning-based MPP models capture molecular property-related features from various molecule representations. In this paper, we propose a molecule sequence embedding and prediction model facing with MPP task. We...

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Detalles Bibliográficos
Autores principales: Wen, Naifeng, Liu, Guanqun, Zhang, Jie, Zhang, Rubo, Fu, Yating, Han, Xu
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2022
Materias:
Research
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9585730/
https://www.ncbi.nlm.nih.gov/pubmed/36271394
http://dx.doi.org/10.1186/s13321-022-00650-3

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9585730/
https://www.ncbi.nlm.nih.gov/pubmed/36271394
http://dx.doi.org/10.1186/s13321-022-00650-3

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