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AI-based Virtual Screening of Traditional Chinese Medicine and the Discovery of Novel Inhibitors of TCTP.

Juxia BaiYangyang NiYuqi ZhangJunfeng WanLiqun LiangHaoran QiaoYanyan ZhuQingjie ZhaoHui-Yu Li
Published in: Current computer-aided drug design (2024)
We have proposed the candidate inhibitor of TCTP. Our study has provided a potential new method for exploring inhibitors from Traditional Chinese Medicine (TCM).
Keyphrases
  • small molecule
  • artificial intelligence
  • high throughput
  • machine learning
  • risk assessment
  • human health
  • deep learning