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  • 标题:DPubChem: a web tool for QSAR modeling and high-throughput virtual screening
  • 本地全文:下载
  • 作者:Othman Soufan ; Wail Ba-alawi ; Arturo Magana-Mora
  • 期刊名称:Scientific Reports
  • 电子版ISSN:2045-2322
  • 出版年度:2018
  • 卷号:8
  • 期号:1
  • 页码:9110
  • DOI:10.1038/s41598-018-27495-x
  • 语种:English
  • 出版社:Springer Nature
  • 摘要:score of 76.68% and 76.53%, respectively. Furthermore, DPubChem builds interaction networks that highlight novel predicted links between chemical compounds and biological assays. Using such a network, DPubChem successfully suggested a novel drug for the Niemann-Pick type C disease. DPubChem is freely available at www.cbrc.kaust.edu.sa/dpubchem .
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