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Exploring chemical space for lead identification by propagating on chemical similarity network
MOTIVATION: Lead identification is a fundamental step to prioritize candidate compounds for downstream drug discovery process. Machine learning (ML) and deep learning (DL) approaches are widely used to identify lead compounds using both chemical property and experimental information. However, ML or...
| Autores principales: | , , , , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Research Network of Computational and Structural Biotechnology
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10480321/ https://www.ncbi.nlm.nih.gov/pubmed/37680266 http://dx.doi.org/10.1016/j.csbj.2023.08.016 |