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Article

Exploring the Binding Affinity and Mechanism between ACE2 and the Trimers of Delta and Omicron Spike Proteins by Molecular Dynamics Simulation and Bioassay.

Journal of chemical information and modeling - 26 Sept 2022

Zhou Liping, Liu Tingting, Mo Mengxia, Shi Yulong, Wu Leyun, Li Yishui, Qin Qiuping, Zhu Weiliang, Wu Chengkun, Gong Likun, Xu Zhijian

Abstract excerpt

Five major variants of severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) have emerged and posed challenges in controlling the pandemic. Among them, the current dominant variant, viz., Omicron, has raised serious concerns about its infectiousness and antibody neutralization. However, few studies pay attention to the effect of the mutations on the dynamic interaction network of Omicron S protein trimers...

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Methodology Data sources Editorial policy Privacy About Contact Helena Bioinformatics

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PMID: 36053674
DOI: 10.1021/acs.jcim.2c00881

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PubMed metadata and Literature Corpus relationships. Corpus snapshot updated 6 Sept 2026.

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