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Updated: May 30, 2025

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HDN-DDI:使用层次分子图形和增强的双视图表示学习预测药物相互作用的新框架

Jinchen Sun1,2, Haoran Zheng3,4

  • 1School of Computer Science and Technology, University of Science and Technology of China, 443 Huangshan Road, Hefei, 230027, China.

BMC bioinformatics
|January 25, 2025
PubMed
概括

本研究介绍了HDN-DDI,这是一种用于使用可解释的子结构和层次分子图来预测药物相互作用 (DDI) 的新框架. HDN-DDI实现了最先进的准确性,并展示了强大的概括性,以提高患者安全.

关键词:
化学子结构 化学子结构药物相互作用 药物相互作用双视图表示学习学习图表注意力网络 图表注意力网络层次化的分子图形.

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