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Transfer learning enables the molecular transformer to predict regio- and stereoselective reactions on carbohydrates

Organic synthesis methodology enables the synthesis of complex molecules and materials used in all fields of science and technology and represents a vast body of accumulated knowledge optimally suited for deep learning. While most organic reactions involve distinct functional groups and can readily...

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Bibliographic Details
Published in:Nat Commun
Main Authors: Pesciullesi, Giorgio, Schwaller, Philippe, Laino, Teodoro, Reymond, Jean-Louis
Format: Artigo
Language:Inglês
Published: Nature Publishing Group UK 2020
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Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC7519051/
https://ncbi.nlm.nih.gov/pubmed/32978395
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41467-020-18671-7
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