Wiley Interdisciplinary Reviews: Computational Molecular Science 2017-12-04

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

Arwa B. Raies, Vladimir B. Bajic

文献索引：10.1002/wcms.1352

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摘要

Comprehensive assessment of multi-label classification methods applied to compounds that may cause several toxicity effects.