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Updated: May 13, 2026

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来自Lawsonia inermis的Pentacyclo-icosan-19'-one化合物作为麻疹病毒H1酸酶抑制剂:分子对接,密度功能理论和分子动力学模拟研究研究

Manoharan Harini1, Arumugam Rajalakshmi1, Kuppuswamy Kavitha2

  • 1PG and Research Department of Biotechnology, Sri Sankara Arts and Science College, University of Madras, Enathur, Kanchipuram, Tamil Nadu 631561 India.

In silico pharmacology
|October 20, 2025
PubMed
概括

研究人员探索了来自印度Materia Medica的天然化合物,作为潜在的抗病毒剂,对抗麻疹病毒 (MPXV) H1酸酶抑制剂. 与对照组相比,化合物表现出更高的结合亲和力和稳定性,这表明MPXV治疗方法的前途很好.

关键词:
密度函数理论密度函数理论H1 酸酶抑制剂的使用印度的医学材料.分子对接是分子对接.模拟分子动力学模拟麻疹病毒 (MPXV) 病毒

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