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Critical Differences between the Binding Features of the Spike Proteins of SARS-CoV-2 and SARS-CoV

17 Jun 2020

Abstract excerpt

The COVID-19 caused by SARS-CoV-2 has spread globally and caused tremendous loss of lives and properties, and it is of utmost urgency to understand its propagation process and to find ways to slow down the epidemic. In this work, we used a coarse-grained model to calculate the binding free energy of SARS-CoV-2 or SARS-CoV to their human receptor ACE2. The investigation of the free energy contribution of the...

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PMID: 32551652
DOI: 10.1021/acs.jpcb.0c04317

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