• Title of article

    Prediction of physicochemical properties from euclidean distance methods based on electrotopological state indices

  • Author/Authors

    Gordon G. Cash، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 1999
  • Pages
    9
  • From page
    2583
  • To page
    2591
  • Abstract
    This paper describes predictions of log KOW, Henryʹs Law constant, vapor pressure, and OH-radical bimolecular rate constant from two Euclidean distance methods, using electrotopological state indices as input. The quality of the predictions is highly dependent on the size of the experimental dataset, i. e., the density of experimental data points in the Euclidean space. The Euclidean distance results are compared with predictions made by commercial software products for the same sets of compounds.
  • Journal title
    Chemosphere
  • Serial Year
    1999
  • Journal title
    Chemosphere
  • Record number

    724467