Predicting toxicity through a computer automated structure evaluation program.

نویسنده

  • G Klopman
چکیده

The computer automated structure evaluation program (CASE) has been extended to perform automatic quantitative structure-activity relationships (QSAR). Applications include the carcinogenicity of polycyclic aromatic hydrocarbons and of N-nitrosamines. Agreement with experiment is satisfactory.

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عنوان ژورنال:
  • Environmental Health Perspectives

دوره 61  شماره 

صفحات  -

تاریخ انتشار 1985