Multitask prediction of site selectivity in aromatic C-H functionalization reactions

Aromatic C–H functionalization reactions are an important part of the synthetic chemistry toolbox. Accurate prediction of site selectivity can be crucial for prioritizing target compounds and synthetic routes in both drug discovery and process chemistry. However, selectivity may be highly dependent...

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Bibliographic Details
Main Authors: Struble, Thomas J, Coley, Connor Wilson, Jensen, Klavs F
Other Authors: Massachusetts Institute of Technology. Department of Chemical Engineering
Format: Article
Published: 2020
Online Access:https://hdl.handle.net/1721.1/125612