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Improved method of structure-based virtual screening based on ensemble learning

Virtual screening has become a successful alternative and complementary technique to experimental high-throughput screening technologies for drug design. Since the scoring function of docking software cannot predict binding affinity accurately, how to improve the hit rate remains a common issue in s...

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Detalles Bibliográficos
Autores principales:	Li, Jin, Liu, WeiChao, Song, Yongping, Xia, JiYi
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2020
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9049841/ https://www.ncbi.nlm.nih.gov/pubmed/35492172 http://dx.doi.org/10.1039/c9ra09211k

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