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Updated: Mar 3, 2026

Incorporating Target Protein Structure Flexibility and Dynamics in Computational Drug Discovery Using Ensemble-Based Docking Analysis
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通过多光谱方法和分子对接模拟的组合,阐明了塞夫多克西姆-BSA相互作用的机制

Reem N El Gammal1, Heba Elmansi2, Ali A El-Emam1

  • 1Department of Medicinal Chemistry, Faculty of Pharmacy, Mansoura University, 35516, Mansoura, Egypt.

Scientific reports
|March 1, 2026
PubMed
概括

这项研究揭示了 cefpodoxime (CFP) 如何与牛血清白蛋白 (BSA) 结合,主要是通过IIA.亚域的疏水相互作用. 了解这种药物蛋白相互作用是预测CFP的关键.

关键词:
牛血清中的牛血清蛋白.塞夫波多西姆的时间.多种光谱学的多种光谱学.

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