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The Development of Target-Specific Pose Filter Ensembles To Boost Ligand Enrichment for Structure-Based Virtual Screening

Structure-based virtual screening (SBVS) has become an indispensable technique for hit identification at the early stage of drug discovery. However, the accuracy of current scoring functions is not high enough to confer success to every target and thus remains to be improved. Previously, we had deve...

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Detalhes bibliográficos
Publicado no:J Chem Inf Model
Main Authors: Xia, Jie, Hsieh, Jui-Hua, Hu, Huabin, Wu, Song, Wang, Xiang Simon
Formato: Artigo
Idioma:Inglês
Publicado em: 2017
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5726860/
https://ncbi.nlm.nih.gov/pubmed/28511009
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.6b00749
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