通过机器学习评估农药的降解效率,包括硫酸盐,芬顿和臭氧化氧化过程

Jingrui Wang1, Xiaoliu Huangfu1, Ruixing Huang2

  • 1Key Laboratory of Eco-Environments in Three Gorges Reservoir Region, Ministry of Education, College of Environment, and Ecology, Chongqing University, Chongqing, 400044, China.

PubMed
概括

这项研究使用分子指纹量化农药结构,以预测机器学习 (ML) 的降解率. 基于计数的摩根指纹-XGBoost模型实现了高精度,为评估有机污染物降解提供了一个新的框架.

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