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Updated: Jan 14, 2026

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通过分子动力学模拟和马尔科夫状态建模,在μ-阿片类受体上阐明Zerumbone的低效率激动作用

Wan Mardhiyana Wan Ayub1, Nurul Amirah Marjohan1, Mohamed Haneif Khalid2

  • 1Faculty of Science and Technology, Universiti Sains Islam Malaysia, 71800, Nilai, Negeri Sembilan, Malaysia.

Journal of computer-aided molecular design
|October 24, 2025
PubMed
概括

泽伦是一种天然化合物,在片受体 (μOR) 起作用为低效的部分激动剂. 这项研究揭示了它的分子相互作用,解释了它的止痛作用和更安全的止痛药的潜力.

关键词:
止痛药 止痛药是一种止痛药.在对接模拟中进行对接模拟.在MMPBSA分析中,分子动力学 (MD) 模拟更安全的阿片类药物替代品一个μ-阿片类受体 (μOR)

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