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Prediction Is a Balancing Act: Importance of Sampling Methods to Balance Sensitivity and Specificity of Predictive Models Based on Imbalanced Chemical Data Sets

Increase in the number of new chemicals synthesized in past decades has resulted in constant growth in the development and application of computational models for prediction of activity as well as safety profiles of the chemicals. Most of the time, such computational models and its application must...

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Detalhes bibliográficos
Publicado no:Front Chem
Main Authors: Banerjee, Priyanka, Dehnbostel, Frederic O., Preissner, Robert
Formato: Artigo
Idioma:Inglês
Publicado em: Frontiers Media S.A. 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6149243/
https://ncbi.nlm.nih.gov/pubmed/30271769
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fchem.2018.00362
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