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Updated: Jul 13, 2025

Incorporating Target Protein Structure Flexibility and Dynamics in Computational Drug Discovery Using Ensemble-Based Docking Analysis
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工程 ACE2 蛋白质的竞争性结合的分子见解和优化策略:多重复制分子动力学研究

Jiahao Sun1, Xinguo Liu1, Shaolong Zhang1

  • 1School of Physics and Electronics, Shandong Normal University, Jinan, 250358, China. liuxinguo@sdnu.edu.cn.

Physical chemistry chemical physics : PCCP
|October 17, 2023
PubMed
概括

通过改变结合机制,工程 ACE2 变种在抑制 SARS-CoV-2 感染方面表现有前途. 确定了优化策略,以提高有效性,并防止免疫系统从不断变化的病毒变体中逃脱.

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