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Comparison of Deep Learning With Multiple Machine Learning Methods and Metrics Using Diverse Drug Discovery Datasets

Machine learning methods have been applied to many datasets in pharmaceutical research for several decades. The relative ease and availability of fingerprint type molecular descriptors paired with Bayesian methods resulted in the widespread use of this approach for a diverse array of endpoints relev...

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Dettagli Bibliografici
Pubblicato in:Mol Pharm
Autori principali: Korotcov, Alexandru, Tkachenko, Valery, Russo, Daniel P, Ekins, Sean
Natura: Artigo
Lingua:Inglês
Pubblicazione: 2017
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC5741413/
https://ncbi.nlm.nih.gov/pubmed/29096442
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.molpharmaceut.7b00578
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