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  1. No Access

    Article

    Investigation of the mechanism of Shen Qi Wan prescription in the treatment of T2DM via network pharmacology and molecular docking

    Shen Qi Wan (SQW) prescription has been used to treat type 2 diabetes mellitus (T2DM) for thousands of years, but its pharmacological mechanism is still unclear. The network pharmacology method was used to rev...

    Piaopiao Zhao, **aoxiao Zhang, Yuning Gong, Weihua Li, Zengrui Wu… in In Silico Pharmacology (2022)

  2. Article

    Open Access

    A multitask GNN-based interpretable model for discovery of selective JAK inhibitors

    The Janus kinase (JAK) family plays a pivotal role in most cytokine-mediated inflammatory and autoimmune responses via JAK/STAT signaling, and administration of JAK inhibitors is a promising therapeutic strate...

    Yimeng Wang, Yaxin Gu, Chaofeng Lou, Yuning Gong, Zengrui Wu… in Journal of Cheminformatics (2022)

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