Assessment of predictivity of volatile organic compounds carcinogenicity and mutagenicity by freeware in silico models.

Abstract

The application of in silico methods is increasing on toxicological risk prediction for human and environmental health. This work aimed to evaluate the performance of three in silico freeware models (OSIRIS v.2.0, LAZAR, and Toxtree) on the prediction of carcinogenicity and mutagenicity of thirty-eight volatile organic compounds (VOC) related to chemical… (More)
DOI: 10.1016/j.yrtph.2017.09.030

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