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Updated: Sep 11, 2025

Analyzing Protein Architectures and Protein-Ligand Complexes by Integrative Structural Mass Spectrometry
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分子动力学驱动的分层几何深度学习框架用于蛋白质-连接体相互作用

Mingquan Liu, Shuting Jin, Houtim Lai

    IEEE transactions on computational biology and bioinformatics
    |August 14, 2025
    PubMed
    概括

    本研究介绍了Dynamics-PLI,这是一个深度学习框架,使用SO(3) -equivariant层次图神经网络 (EHGNNs) 进行蛋白质-连接体结合预测. 它通过结合残留水平信息和分子动态数据,显著提高了准确性.

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    相关概念视频

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