Reaction performance prediction with an extrapolative and interpretable graph model based on chemical knowledge

por Li, Shu-Wen, Xu, Li-Cheng, Zhang, Cheng, Zhang, Shuo-Qing, Hong, Xin
Publicado 2023

Unsymmetric N-heterocyclic carbene ligand enabled nickel-catalysed arylation of bulky primary and secondary amines

por Wang, Zi-Chao, Li, Yan-Yu, Zhang, Shuo-Qing, Hong, Xin, Shi, Shi-Liang
Publicado 2023

Stereoselective alkoxycarbonylation of unactivated C(sp(3))–H bonds with alkyl chloroformates via Pd(II)/Pd(IV) catalysis

por Liao, Gang, Yin, Xue-Song, Chen, Kai, Zhang, Qi, Zhang, Shuo-Qing, Shi, Bing-Feng
Publicado 2016

Bridging Chemical Knowledge and Machine Learning for Performance Prediction of Organic Synthesis

por Zhang, Shuo‐Qing, Xu, Li‐Cheng, Li, Shu‐Wen, Oliveira, João C. A., Li, Xin, Ackermann, Lutz, Hong, Xin
Publicado 2022

Divergent rhodium-catalyzed electrochemical vinylic C–H annulation of acrylamides with alkynes

por Xing, Yi-Kang, Chen, Xin-Ran, Yang, Qi-Liang, Zhang, Shuo-Qing, Guo, Hai-Ming, Hong, Xin, Mei, Tian-Sheng
Publicado 2021

Data-driven design of new chiral carboxylic acid for construction of indoles with C-central and C–N axial chirality via cobalt catalysis

por Zhang, Zi-Jing, Li, Shu-Wen, Oliveira, João C. A., Li, Yanjun, Chen, Xinran, Zhang, Shuo-Qing, Xu, Li-Cheng, Rogge, Torben, Hong, Xin, Ackermann, Lutz
Publicado 2023

Carboxylate breaks the arene C–H bond via a hydrogen-atom-transfer mechanism in electrochemical cobalt catalysis

por Chen, Xin-Ran, Zhang, Shuo-Qing, Meyer, Tjark H., Yang, Chun-Hui, Zhang, Qin-Hao, Liu, Ji-Ren, Xu, Hua-Jian, Cao, Fa-He, Ackermann, Lutz, Hong, Xin
Publicado 2020