Author

Yajie Li

Central South UniversityORCID 0000-0003-4800-5006Unclaimed ORCID profile · follow to get notified of new preprints

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Bioinformatics· 1

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Approach:contrastive learning· 1 Research Focus:drug response / drug discovery· 1 Approach:graph neural network· 1

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Jianxin WangiD· 1 shared Qichang ZhaoiD· 1 shared

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2025-2025 · peak 1/yr

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Jianxin WangORCID

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1 paper

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BioinformaticsbioRxivPreprintNov 9, 2025

PyrMol: A Knowledge-Structured Pyramid Graph Framework forGeneralizable Molecular Property Prediction

Yajie Li, Qichang Zhao, Jianxin Wang

PyrMol improves molecular property prediction by integrating expert knowledge into a hierarchical graph framework, outperforming existing methods on benchmark datasets.

DOI 10.1101/2025.11.09.686426

graph neural networkcontrastive learning

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