Predicting Reaction Outcomes
Oxidation of Alkenes: Syn Dihydroxylation with Potassium Permanganate
Oxidation of Alkenes: Syn Dihydroxylation with Osmium Tetraoxide
Preparation of Epoxides
Reduction of Alkenes: Asymmetric Catalytic Hydrogenation
Sharpless Epoxidation
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José Ferraz-Caetano1, Filipe Teixeira2, M Natália D S Cordeiro1
1LAQV-REQUIMTE - Department of Chemistry and Biochemistry - Faculty of Sciences, University of Porto, Rua do Campo Alegre, S/N, 4169-007 Porto, Portugal.
本研究引入了一种监督机器学习模型,用于预测催化环氧化产量,改进催化剂设计和反应优化. 该模型达到90%的准确性,有助于开发高效的化学合成.
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