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Cheminformatics tools for analyzing and designing optimized small molecule collections and libraries
Libraries of well-annotated small molecules have many uses in chemical genetics, drug discovery and therapeutic repurposing. Multiple libraries are available, but few data-driven approaches exist to compare them and design new libraries. We describe an approach to scoring and creating libraries base...
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| Publié dans: | Cell Chem Biol |
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| Auteurs principaux: | , , , , , , , , , |
| Format: | Artigo |
| Langue: | Inglês |
| Publié: |
2019
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| Sujets: | |
| Accès en ligne: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6526536/ https://ncbi.nlm.nih.gov/pubmed/30956147 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.chembiol.2019.02.018 |
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