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30 积分 2023-10-21 加入
Machine learning approaches for transition state prediction
12小时前
求助中
Predicting band gaps of MOFs on small data by deep transfer learning with data augmentation strategies
5天前
已完结
Conformational Sampling for Transition State Searches on a Computational Budget
19天前
已完结
Methods for exploring reaction space in molecular systems: Exploring reaction space in molecular systems
21天前
已完结
Methods for exploring reaction space in molecular systems
21天前
已完结
A Survey on Generative Diffusion Models
23天前
已完结
Copper-Catalyzed Chemo-, Regio-, and Stereoselective Ring-Opening sp2/sp3 Diborylation of Arylidenecyclopropanes
26天前
已完结
Toward Iridium-Catalyzed Asymmetric Branched-Selective α-Alkylation of Aldehydes with Unactivated Alkenes Enabled by a Pyrazole Mediator
1个月前
已完结
Nickel-catalysed enantioselective migratory reductive cross-coupling enabled by radical 1,2-amino migration
1个月前
已完结
金属钯-有机配位笼和过渡金属催化的反应的理论与计算研究
1个月前
已完结
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