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Updated: Feb 4, 2026

Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
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通过虚拟查和分子动力学模拟,发现一种用于神经退行的新型Keap1抑制剂

Md Mazedul Hasan1, Md Shaki Mostaid1, Asim Kumar Bepari1

  • 1Department of Pharmaceutical Sciences, North South University, Dhaka, Bangladesh.

PloS one
|February 2, 2026
PubMed
概括

海洋天然产品为神经退行性疾病提供了潜在的治疗方法. 研究人员发现了一种新型化合物,145398-61-4,它抑制了Keap1-Nrf2相互作用,这是阿尔茨海默病的关键途径.

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