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“Found in Translation”: predicting outcomes of complex organic chemistry reactions using neural sequence-to-sequence models

There is an intuitive analogy of an organic chemist's understanding of a compound and a language speaker's understanding of a word. Based on this analogy, it is possible to introduce the basic concepts and analyze potential impacts of linguistic analysis to the world of organic chemistry....

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Detalhes bibliográficos
Publicado no:Chem Sci
Main Authors: Schwaller, Philippe, Gaudin, Théophile, Lányi, Dávid, Bekas, Costas, Laino, Teodoro
Formato: Artigo
Idioma:Inglês
Publicado em: Royal Society of Chemistry 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6053976/
https://ncbi.nlm.nih.gov/pubmed/30090297
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c8sc02339e
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