Deciphering the free energy landscapes of SARS-CoV-2 wild type and Omicron variant interacting with human ACE2
The binding of the receptor binding domain (RBD) of the SARS-CoV-2 spike protein to the
host cell receptor angiotensin-converting enzyme 2 (ACE2) is the first step in human viral …
host cell receptor angiotensin-converting enzyme 2 (ACE2) is the first step in human viral …
Origin of the tight binding mode to ACE2 triggered by multi-point mutations in the omicron variant: A dynamic insight
The continuous spread of the newly emerged SARS-CoV-2 Omicron variant (B. 1.1. 529)
has become an important reason for the surge in COVID-19 infections. Its numerous mutated …
has become an important reason for the surge in COVID-19 infections. Its numerous mutated …
Binding of human ACE2 and RBD of omicron enhanced by unique interaction patterns among SARS‐CoV‐2 variants of concern
Severe acute respiratory syndrome coronavirus 2 (SARS‐CoV‐2), the virus causing COVID‐
19, has continued to mutate and spread worldwide despite global vaccination efforts. In …
19, has continued to mutate and spread worldwide despite global vaccination efforts. In …
Key residues of the receptor binding domain in the spike protein of SARS-CoV-2 mediating the interactions with ACE2: a molecular dynamics study
The widespread coronavirus disease 2019 (COVID-19) has been declared a global health
emergency. As one of the most important targets for antibody and drug developments, the …
emergency. As one of the most important targets for antibody and drug developments, the …
Mechanistic insights into the effects of key mutations on SARS-CoV-2 RBD–ACE2 binding
Some recent SARS-CoV-2 variants appear to have increased transmissibility compared to
the original strain. An underlying mechanism could be the improved ability of the variants to …
the original strain. An underlying mechanism could be the improved ability of the variants to …
SARS-CoV-2 Omicron Subvariants Do Not Differ Much in Binding Affinity to Human ACE2: A Molecular Dynamics Study
The emergence of the variant of concern Omicron (B. 1.1. 529) of severe acute respiratory
syndrome coronavirus 2 (SARS-CoV-2) exacerbates the COVID-19 pandemic due to its high …
syndrome coronavirus 2 (SARS-CoV-2) exacerbates the COVID-19 pandemic due to its high …
Decreased interfacial dynamics caused by the N501Y mutation in the SARS-CoV-2 S1 spike: ACE2 complex
Corona virus disease of 2019 (COVID-19) caused by severe acute respiratory syndrome
corona virus 2 (SARS-CoV-2) has caused a massive health crisis across the globe, with …
corona virus 2 (SARS-CoV-2) has caused a massive health crisis across the globe, with …
Scanning the RBD-ACE2 molecular interactions in Omicron variant
The emergence of new SARS-CoV-2 variants poses a threat to the human population where
it is difficult to assess the severity of a particular variant of the virus. Spike protein and …
it is difficult to assess the severity of a particular variant of the virus. Spike protein and …
Riding the wave: Unveiling the conformational waves from RBD of SARS-CoV-2 spike protein to ACE2
N Maroli - The Journal of Physical Chemistry B, 2023 - ACS Publications
The binding affinity between angiotensin-converting enzyme 2 (ACE2) and the receptor-
binding domain (RBD) plays a crucial role in the transmission and reinfection of SARS …
binding domain (RBD) plays a crucial role in the transmission and reinfection of SARS …
The Recognition Pathway of the SARS-CoV-2 Spike Receptor-Binding Domain to Human Angiotensin-Converting Enzyme 2
COVID-19 caused by SARS-CoV-2 has spread around the world. The receptor-binding
domain (RBD) of the spike protein of SARS-CoV-2 is a critical component that directly …
domain (RBD) of the spike protein of SARS-CoV-2 is a critical component that directly …
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