Chemistry-informed deep learning model for predicting stereoselectivity and absolute configuration in asymmetric hydrogenation

作者：Cheng Li, Pan‐Lin Shao, Jiahui Lv, Hongjun Xiao, Yanping Sun, Jingkai Yang, Ziyi Xu, Mingkun Lv, Guanghui Wang, Songlin Zhao, Jiaxin Li, Ziqi Jin, Xuan Tan, Guichuan Xing, Bo Zhang · 发表于：Nature Computational Science · 年份：2025 · DOI：10.1038/s43588-025-00920-8 · 被引用次数：5 · 研究领域：Machine Learning in Materials Science、Asymmetric Hydrogenation and Catalysis、Organoboron and organosilicon chemistry