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Deep Neural Networks for Multicomponent Molecular Systems

[Image: see text] Deep neural networks (DNNs) represent promising approaches to molecular machine learning (ML). However, their applicability remains limited to single-component materials and a general DNN model capable of handling various multicomponent molecular systems with composition data is st...

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Detalhes bibliográficos
Publicado no:ACS Omega
Autor principal: Hanaoka, Kyohei
Formato: Artigo
Idioma:Inglês
Publicado em: American Chemical Society 2020
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7450624/
https://ncbi.nlm.nih.gov/pubmed/32875241
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.0c02599
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