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Optimizing Chemical Reactions with Deep Reinforcement Learning

[Image: see text] Deep reinforcement learning was employed to optimize chemical reactions. Our model iteratively records the results of a chemical reaction and chooses new experimental conditions to improve the reaction outcome. This model outperformed a state-of-the-art blackbox optimization algori...

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Detalhes bibliográficos
Publicado no:ACS Cent Sci
Main Authors: Zhou, Zhenpeng, Li, Xiaocheng, Zare, Richard N.
Formato: Artigo
Idioma:Inglês
Publicado em: American Chemical Society 2017
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5746857/
https://ncbi.nlm.nih.gov/pubmed/29296675
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acscentsci.7b00492
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