CatBoost-Based Framework for Intelligent Prediction and Reaction Condition Analysis of Coupling Reaction

DOI10.46793/match.90-1.053wzbMath1519.92370OpenAlexW4321440441MaRDI QIDQ6167500

Unnamed Author, Unnamed Author, Lichao Peng, Hengzhe Wang, Yanhui Guo, Li Chang, Xiao-Hui Yang

Publication date: 10 July 2023

Published in: Match Communications in Mathematical and in Computer Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.46793/match.90-1.053w

Mathematics Subject Classification ID

Classical flows, reactions, etc. in chemistry (92E20)

Cites Work

• Greedy function approximation: A gradient boosting machine.
• Intelligent predicting reaction performance in multi-dimensional chemical space using quantile regression forest
• Random forests
• Unnamed Item