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Missed opportunities in large scale comparison of QSAR and conformal prediction methods and their applications in drug discovery
Recently Bosc et al. (J Cheminform 11(1): 4, 2019), published an article describing a case study that directly compares conformal predictions with traditional QSAR methods for large-scale predictions of target-ligand binding. We consider this study to be very important. Unfortunately, we have found...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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Springer International Publishing
2019
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6833156/ https://www.ncbi.nlm.nih.gov/pubmed/33430942 http://dx.doi.org/10.1186/s13321-019-0387-y |