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When drug discovery meets web search: Learning to Rank for ligand-based virtual screening

BACKGROUND: The rapid increase in the emergence of novel chemical substances presents a substantial demands for more sophisticated computational methodologies for drug discovery. In this study, the idea of Learning to Rank in web search was presented in drug virtual screening, which has the followin...

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Détails bibliographiques
Publié dans:J Cheminform
Auteurs principaux: Zhang, Wei, Ji, Lijuan, Chen, Yanan, Tang, Kailin, Wang, Haiping, Zhu, Ruixin, Jia, Wei, Cao, Zhiwei, Liu, Qi
Format: Artigo
Langue:Inglês
Publié: Springer International Publishing 2015
Sujets:
Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC4333300/
https://ncbi.nlm.nih.gov/pubmed/25705262
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-015-0052-z
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