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Published in 2017 at "Molecular Informatics"
DOI: 10.1002/minf.201600133
Abstract: The identification of structural alerts is one of the simplest tools used for the identification of potentially toxic chemical compounds. Structural alerts have served as an aid to quickly identify chemicals that should be either…
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Keywords:
structural alerts;
fragment prioritization;
mutagenicity dataset;
mutagenicity ... See more keywords