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Benchmarking Methods and Data Sets for Ligand Enrichment Assessment in Virtual Screening
Retrospective small-scale virtual screening (VS) based on benchmarking data sets has been widely used to estimate ligand enrichments of VS approaches in the prospective (i.e. real-world) efforts. However, the intrinsic differences of benchmarking sets to the real screening chemical libraries can cau...
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| Опубликовано в: : | Methods |
|---|---|
| Главные авторы: | , , , , |
| Формат: | Artigo |
| Язык: | Inglês |
| Опубликовано: |
2014
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| Предметы: | |
| Online-ссылка: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4278665/ https://ncbi.nlm.nih.gov/pubmed/25481478 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.ymeth.2014.11.015 |
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