Intelligent predicting reaction performance in multi-dimensional chemical space using quantile regression forest

DOI10.46793/match.87-2.299PzbMath1502.92027MaRDI QIDQ5051955

Jing Dong, Puyu Zhang, Xuechun Mu, Lichao Peng, Zelin Zhang, Yu Qing Zhang, Xiao-Hui Yang

Publication date: 18 November 2022

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

Mathematics Subject Classification ID

Nonparametric regression and quantile regression (62G08) Classical flows, reactions, etc. in chemistry (92E20) Applications of statistics (62P99)

Related Items (2)

Regression Prediction of Coupling Reaction Yield Based on Attention-Driven Convolutional Neural Network ⋮ CatBoost-Based Framework for Intelligent Prediction and Reaction Condition Analysis of Coupling Reaction

Cites Work

• Regression Quantiles
• Comparison of Discrimination Methods for the Classification of Tumors Using Gene Expression Data
• Random forests
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