Enantioselectivity prediction of pallada-electrocatalysed C–H activation using transition state knowledge in machine learning

Summary

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Authors: Li-Cheng Xu; Johanna Frey; Xiaoyan Hou; Shuo-Qing Zhang; Yan-Yu Li; João C. A. Oliveira; Shu-Wen Li; Lutz Ackermann; Xin Hong

Journal title: nature synthesis

Journal publisher: Springer

Published year: 2023

DOI identifier: 10.1038/s44160-022-00233-y

ISSN: 2731-0582