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Fragment-pair based drug molecule solubility prediction through attention mechanism
The purpose of drug discovery is to identify new drugs, and the solubility of drug molecules is an important physicochemical property in medicinal chemistry, that plays a crucial role in drug discovery. In solubility prediction, high-precision computational methods can significantly reduce the exper...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Frontiers Media S.A.
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10595153/ https://www.ncbi.nlm.nih.gov/pubmed/37881183 http://dx.doi.org/10.3389/fphar.2023.1255181 |