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Benchmark of four popular virtual screening programs: construction of the active/decoy dataset remains a major determinant of measured performance
BACKGROUND: In a structure-based virtual screening, the choice of the docking program is essential for the success of a hit identification. Benchmarks are meant to help in guiding this choice, especially when undertaken on a large variety of protein targets. Here, the performance of four popular vir...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer International Publishing
2016
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5066283/ https://www.ncbi.nlm.nih.gov/pubmed/27803745 http://dx.doi.org/10.1186/s13321-016-0167-x |