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Validation Study of QSAR/DNN Models Using the Competition Datasets

Since the QSAR/DNN model showed predominant predictive performance over other conventional methods in the Kaggle QSAR competition, many artificial neural network (ANN) methods have been applied to drug and material discovery. Appearance of artificial intelligence (AI), which is combined various gene...

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Detalles Bibliográficos
Autores principales: Kato, Yoshiki, Hamada, Shinji, Goto, Hitoshi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7050538/
https://www.ncbi.nlm.nih.gov/pubmed/31802634
http://dx.doi.org/10.1002/minf.201900154