Publications by authors named "Zeguo Yang"

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How to track the dumped waste? From data collection to advanced source identification.
Wenxi Liang, Lijia Fan, Zeguo Yang, Jinzhong Yang, Qiuxia Zou, Jiakuan Yang

J Hazard Mater· November 2025

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Molecular designing of potential environmentally friendly PFAS based on deep learning and generative models.
Ying Yang, Zeguo Yang, Xudi Pang, Huiming Cao, Yuzhen Sun

Sci Total Environ· November 2024

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NeuTox: A weighted ensemble model for screening potential neuronal cytotoxicity of chemicals based on various types of molecular representations.
Xuejun He, Zeguo Yang, Ling Wang, Yuzhen Sun, Huiming Cao

J Hazard Mater· March 2024

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Screening of the Antagonistic Activity of Potential Bisphenol A Alternatives toward the Androgen Receptor Using Machine Learning and Molecular Dynamics Simulation.
Zeguo Yang, Ling Wang, Ying Yang, Xudi Pang, Yuzhen Sun

Environ Sci Technol· February 2024

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Investigation of the Binding Fraction of PFAS in Human Plasma and Underlying Mechanisms Based on Machine Learning and Molecular Dynamics Simulation.
Huiming Cao, Jianhua Peng, Zhen Zhou, Zeguo Yang, Ling Wang

Environ Sci Technol· November 2023

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