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Identifying Differences in the Performance of Machine Learning Models for Off-Targets Trained on Publicly Available and Proprietary Data Sets
[Image: see text] Each year, publicly available databases are updated with new compounds from different research institutions. Positive experimental outcomes are more likely to be reported; therefore, they account for a considerable fraction of these entries. Established publicly available databases...
Autores principales: | Smajić, Aljoša, Rami, Iris, Sosnin, Sergey, Ecker, Gerhard F. |
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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/PMC10445286/ https://www.ncbi.nlm.nih.gov/pubmed/37439496 http://dx.doi.org/10.1021/acs.chemrestox.3c00042 |
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