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Mutagenesis vol. 5 no. 5 pp. 425-432, 1990
© 1990 UK Environmental Mutagen Society/Oxford University Press

discussion

Prediction of the carcinogenicity in rodents of chemicals currently being tested by the US National Toxicology Program: structure-activity correlations

Herbert S. Rosenkranz and Gilles Klopman

Departments of Environmental Health Sciences and Chemistry, Case Western Reserve University Cleveland, OH 44106, USA

CASE, an artificial intelligence structure-activity relational system, was used to predict the carcinogenicity of a group of chemicals currently being tested in rodent bioassays by the US National Toxicology Program. The ‘learning set’ for the CASE predictions consisted of the results of previous 252 rodent carcinogenicity bioassays.


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