Retention time prediction of emerging contaminants via transfer learning with graph neural networks

Journal of Hazardous Materials 2026

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Authors: Jiewen Deng, Junbin Chen, Junbin Chen, Jingyi Wang, Xingying Li, Sisi Liu, Linke Ge, Guang-Guo Ying, Chang-Er Chen

DOI: 10.1016/j.jhazmat.2026.141313

Cited by: 2

References: 11

Fields of Study & Subjects

Computational Drug Discovery Methods Metabolomics and Mass Spectrometry Studies Pharmacogenetics and Drug Metabolism

References 11