Discovery of novel chemical reactions by deep generative recurrent neural network

HIGHLIGHTS

• who: William Bort from the LaboratoryUniversity of have published the article: Discovery of novel chemical reactions by deep generative recurrent neural network, in the Journal: Scientific Reports Scientific Reports
• what: In the experiment, bromotriarylsilane was used as ­template57 (reaction 19 in Table S5) whereas the tool proposed less stable di-substituted silane bromide possibly with heteroatoms surrounding silicon (reactions 8 and 9 in Table 1).
• how: The authors also decided to discard the unfeasible under normal conditions transformations consisting in the cleavage of a C-C bond and assuming a carbon-centric leaving . . .
  

   

  

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