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Assessing How Residual Errors of Scoring Functions Correlate to Ligand Structural Features
Scoring functions (SFs) are ubiquitous tools for early stage drug discovery. However, their accuracy currently remains quite moderate. Despite a number of successful target-specific SFs appearing recently, up until now, no ideas on how to systematically improve the general scope of SFs have been for...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2022
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9739603/ https://www.ncbi.nlm.nih.gov/pubmed/36499344 http://dx.doi.org/10.3390/ijms232315018 |