David Koes edited Toxtree_is_a_Java_application__.tex  about 8 years ago

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Toxtree is a Java GUI  application which estimates toxic hazard for estimating the ``toxic hazard'' of molecules using a variety  ofchemical compounds. It offers several  toxicity prediction modules, including cramer rules (oral toxicity), toxicity mode of action via Verhaar scheme, such as oral toxicity,  skinirritation  and eye irritation prediction,structural alerts associated with  covalent protein binding and DNA binding, Cytochrome P450-mediated drug metabolism and metabolites prediction (using SMARTCyp)  and more. \cite{Patlewicz_2008}