Descriptor-driven interpretable machine learning: Structure–activity relationship interpretation for N-doped carbon/PMS systems and prediction of BPA degradation efficiency

Process Safety and Environmental Protection 2026

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Authors: Jiajun Sun, Yintao Shi, Chenyu Song, Xiaorong Xiong, He Zhou, Jing Hu, Dongsheng Xia

DOI: 10.1016/j.psep.2026.108907

Cited by: 1

References: 41

Fields of Study & Subjects

Machine Learning in Materials Science Computational Drug Discovery Methods Advanced Graph Neural Networks

References 41