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Updated: May 25, 2025

Drug Repurposing Hypothesis Generation Using the "RE:fine Drugs" System
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重新使用FDA批准的药物来开发原型杆菌激酶 (HPSK) 抑制剂:使用虚拟查,MM-GBSA计算,MD模拟和DFT分析的计算方法

Abdulaziz H Al Khzem1, Tagyedeen H Shoaib2, Rua M Mukhtar2

  • 1Department of Pharmaceutical Chemistry, College of Clinical Pharmacy, Imam Abdulrahman Bin Faisal University, P.O. Box 1982, Dammam 31441, Saudi Arabia.

Pharmaceuticals (Basel, Switzerland)
|February 26, 2025
PubMed
概括

计算机辅助药物设计确定了对抗抗生素耐药Helicobacter pylori感染的有前途的新药. 经FDA批准的药物显示出潜在的病原体抑制剂的潜力.

关键词:
对DFT的分析在Helicobacter Pylori的研究中,计算研究是计算研究.分子模拟,分子模拟.重新调整使用目的.石基酸激酶是一种

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