Cargando…
Rationalizing general limitations in assessing and comparing methods for compound potency prediction
Compound potency predictions play a major role in computational drug discovery. Predictive methods are typically evaluated and compared in benchmark calculations that are widely applied. Previous studies have revealed intrinsic limitations of potency prediction benchmarks including very similar perf...
| Autores principales: | , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group UK
2023
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10587074/ https://www.ncbi.nlm.nih.gov/pubmed/37857835 http://dx.doi.org/10.1038/s41598-023-45086-3 |