• DocumentCode
    1597746
  • Title

    Empirical Study on Modeling Quantitative Composition- Activity Relationships in Chinese Herbal Medicine

  • Author

    Wang, Xuewei ; Wang, Yi ; Cheng, Yiyu

  • Author_Institution
    Pharm. Informatics Inst., Zhejiang Univ., Hangzhou
  • fYear
    2005
  • fDate
    6/27/1905 12:00:00 AM
  • Firstpage
    7722
  • Lastpage
    7725
  • Abstract
    Chinese herbal medicine (CHM) consists of up hundreds of chemical components, which have complex relationships with their bioactivities. Quantitatively modeling composition-activity relationships playing a crucial role in drug design from CHM. In this paper, principle component regression, partial least square regression and least square support vector machine were used to perform this task and exhibit high predictive precisions
  • Keywords
    drugs; least squares approximations; physiological models; principal component analysis; regression analysis; support vector machines; Chinese herbal medicine; drug design; least square support vector machine; partial least square regression; principle component regression; quantitative composition-activity relationships; Asia; Biological system modeling; Biomedical informatics; Chemicals; Drugs; Least squares methods; Pharmaceuticals; Predictive models; Principal component analysis; Support vector machines;
  • fLanguage
    English
  • Publisher
    ieee
  • Conference_Titel
    Engineering in Medicine and Biology Society, 2005. IEEE-EMBS 2005. 27th Annual International Conference of the
  • Conference_Location
    Shanghai
  • Print_ISBN
    0-7803-8741-4
  • Type

    conf

  • DOI
    10.1109/IEMBS.2005.1616302
  • Filename
    1616302