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基于结构的发现,thiosemicarbazones作为SARS-CoV-2的主要蛋白酶抑制剂

Vinícius Gonçalves Maltarollo1, Elany Barbosa da Silva2, Thales Kronenberger3,4,5,6

  • 1Departamento de Produtos Farmacêuticos, Faculdade de Farmácia, Universidade Federal de Minas Gerais, 31270-901, Brazil.

Future medicinal chemistry
|July 12, 2023
PubMed
概括

研究人员发现了新的 thiosemicarbazones 作为SARS-CoV-2 主蛋白酶 (Mpro) 的强有力的抑制剂. 这种基于结构的药物发现方法确定了对病毒和相关蛋白酶有效的化合物.

关键词:
在Mpro Mpro中使用.这就是SARS-CoV-2病毒.计算机辅助药物设计新冠肺炎病毒新冠肺炎病毒分子对接的分子对接.分子动力学模拟的模拟.蛋白酶抑制剂是一种蛋白酶抑制剂.虚拟选 虚拟选 虚拟选

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