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Data-driven approaches used for compound library design, hit triage and bioactivity modeling in high-throughput screening

High-throughput screening (HTS) campaigns are routinely performed in pharmaceutical companies to explore activity profiles of chemical libraries for the identification of promising candidates for further investigation. With the aim of improving hit rates in these campaigns, data-driven approaches ha...

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Detalhes bibliográficos
Publicado no:Brief Bioinform
Main Authors: Paricharak, Shardul, Méndez-Lucio, Oscar, Chavan Ravindranath, Aakash, Bender, Andreas, IJzerman, Adriaan P, van Westen, Gerard J P
Formato: Artigo
Idioma:Inglês
Publicado em: Oxford University Press 2016
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6018726/
https://ncbi.nlm.nih.gov/pubmed/27789427
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1093/bib/bbw105
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