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Updated: May 11, 2025

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通过高吞吐量虚拟查发现了新的HBV核心蛋白抑制剂

Jahanvi Sanchitra1, Abhijit Debnath2, Anil Kumar Singh3

  • 1Noida Institute of Engineering and Technology [Pharmacy Institute], 19 Knowledge Park-II, Institutional Area, Greater Noida, Uttar Pradesh, India.

Scientific reports
|April 16, 2025
PubMed
概括

研究人员使用计算查确定了一种新的乙型肝炎病毒 (HBV) 核心蛋白抑制剂ZINC00674395,ZINC00674395. 这种化合物显示出作为慢性HBV感染的潜在治疗剂的前景.

关键词:
计算机化药物发现.共识分子对接 达成共识分子对接肝炎病毒囊集成抑制剂HBV囊集成抑制剂分子动力学模拟模型基于结构的虚拟选.

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