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Multi-Level Comparison of Machine Learning Classifiers and Their Performance Metrics

Machine learning classification algorithms are widely used for the prediction and classification of the different properties of molecules such as toxicity or biological activity. The prediction of toxic vs. non-toxic molecules is important due to testing on living animals, which has ethical and cost...

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Detalhes bibliográficos
Publicado no:Molecules
Main Authors: Rácz, Anita, Bajusz, Dávid, Héberger, Károly
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6695655/
https://ncbi.nlm.nih.gov/pubmed/31374986
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules24152811
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