Benigni/ Bossa rulebase (for mutagenicity and cancerogenicity).
A decision tree for estimating carcinogenicity and mutagenicity by discriminant analysis and structural rules, based on published in the document [Benigni 2008];
Available since ToxTree 1.30.
The structure alerts have been updated since ToxTree 2.60, according to [Benigni 2013].
- Benigni 2007
- R. Benigni, C. Bossa, T. Netzeva, A. Rodomonte, and I. Tsakovska (2007) Mechanistic QSAR of aromatic amines: new models for discriminating between mutagens and nonmutagens, and validation of models for carcinogens. Environ mol mutag 48:754-771
- Benigni 2008
- R. Benigni, C. Bossa, N. Jeliazkova, T. Netzeva, and A. Worth. The Benigni / Bossa rulebase for mutagenicity and carcinogenicity - a module of Toxtree (European Commission report EUR 23241)
- Benigni 2013
- Benigni, R., Bossa, C., & Tcheremenskaia, O. (2013). Nongenotoxic carcinogenicity of chemicals: mechanisms of action and early recognition through a new set of structural alerts. Chemical Reviews, 113(5), 2940�57. doi:10.1021/cr300206t