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SophosQM: Accurate Binding Affinity Prediction in Compound Optimization
[Image: see text] The optimization of compounds’ binding affinity for a biological target is a crucial aspect of the drug development process. Being able to accurately predict binding energies in advance of synthesizing compounds would have a massive impact on the speed of the drug discovery process...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2023
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10157843/ https://www.ncbi.nlm.nih.gov/pubmed/37151542 http://dx.doi.org/10.1021/acsomega.2c08132 |