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在ASINEX数据库中使用综合分子建模方法在体中识别潜在的p53-MDM2抑制剂

Dushyant D Kotadiya1, Apurva Prajapati1, Dharmesh A Patel1

  • 1Department of Chemistry, School of Sciences, Gujarat University, Ahmedabad, Gujarat, India.

Scientific reports
|October 6, 2025
PubMed
概括

研究人员确定了针对MDM2的新型小分子抑制剂,以恢复癌症中瘤抑制剂p53的功能. 这些化合物通过重新激活p53-MDM2通路,有望开发新的癌症疗法.

关键词:
接收人 接收人在 DFT 方面,它是最重要的.分子对接 分子对接分子动力学分子动力学这是一种P53-MDM2抑制剂.虚拟选是一个虚拟的选.

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