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In silico toxicology: comprehensive benchmarking of multi‐label classification methods applied to chemical toxicity data

One goal of toxicity testing, among others, is identifying harmful effects of chemicals. Given the high demand for toxicity tests, it is necessary to conduct these tests for multiple toxicity endpoints for the same compound. Current computational toxicology methods aim at developing models mainly to...

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Veröffentlicht in:Wiley Interdiscip Rev Comput Mol Sci
Hauptverfasser: Raies, Arwa B., Bajic, Vladimir B.
Format: Artigo
Sprache:Inglês
Veröffentlicht: Wiley Periodicals, Inc. 2017
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5947741/
https://ncbi.nlm.nih.gov/pubmed/29780432
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/wcms.1352
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