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A merged molecular representation learning for molecular properties prediction with a web-based service
Deep learning has brought a dramatic development in molecular property prediction that is crucial in the field of drug discovery using various representations such as fingerprints, SMILES, and graphs. In particular, SMILES is used in various deep learning models via character-based approaches. Howev...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group UK
2021
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8155205/ https://www.ncbi.nlm.nih.gov/pubmed/34040026 http://dx.doi.org/10.1038/s41598-021-90259-7 |