[HTML][HTML] … analysis of novel coronavirus (SARS-CoV-2) from different geographical locations and the effect of mutations on major target proteins: An in silico insight
… This study provides a deeper insight into the emergence of these mutations within the major
… SARS-CoV-2 genome from different countries. Here, molecular dynamics and other in silico …
… SARS-CoV-2 genome from different countries. Here, molecular dynamics and other in silico …
[HTML][HTML] C60 fullerene against SARS-CoV-2 coronavirus: an in silico insight
VV Hurmach, MO Platonov, SV Prylutska, P Scharff… - Scientific reports, 2021 - nature.com
… silico approach allows simulating the behavior of C 60 fullerene in the binding sites of
SARS-CoV-2 coronavirus … In a recent study 78 , spike protein of SARS-CoV-2 was found to interact …
SARS-CoV-2 coronavirus … In a recent study 78 , spike protein of SARS-CoV-2 was found to interact …
In silico insight into the interaction of 4-aminoquinolines with selected SARS-CoV-2 structural and nonstructural proteins
H Tijjani, A Olatunde, AP Adegunloye… - Coronavirus Drug …, 2022 - Elsevier
… profile in combating SARS-CoV-2. Thus, the present study uses in silico models to investigate
… (E, M, N, and S) and nonstructural proteins (3CLpro, PLpro, and RdRp) of SARS-CoV-2. …
… (E, M, N, and S) and nonstructural proteins (3CLpro, PLpro, and RdRp) of SARS-CoV-2. …
[HTML][HTML] In silico insights into the sars cov-2 main protease suggest nadh endogenous defences in the control of the pandemic coronavirus infection
… In this study, we proposed an in silico protocol to provide insights into the mechanism of
action that governs the activity of the SARS-CoV-2 main protease and to propose new potential …
action that governs the activity of the SARS-CoV-2 main protease and to propose new potential …
ACE2 polymorphisms and individual susceptibility to SARS-CoV-2 infection: insights from an in silico study
… In this study we have used a combination of in silico tools to analyze the possible impact
of ACE2 single-nucleotide polymorphisms (SNPs) on the interaction with SARS-CoV-2 Spike …
of ACE2 single-nucleotide polymorphisms (SNPs) on the interaction with SARS-CoV-2 Spike …
In silico analysis of the aggregation propensity of the SARS-CoV-2 proteome: Insight into possible cellular pathologies
… Taking all of these into account, this work provides new insights into the importance of
understanding and studying the long-term effects of the SARS-CoV-2 infection. Additionally, it …
understanding and studying the long-term effects of the SARS-CoV-2 infection. Additionally, it …
[HTML][HTML] Insights into the biased activity of dextromethorphan and haloperidol towards SARS-CoV-2 NSP6: in silico binding mechanistic analysis
… The outbreak of novel coronavirus disease 2019 (COVID-19) caused by severe … coronavirus-2
(SARS-CoV-2) virus continually led to infect a large population worldwide. SARS-CoV-2 …
(SARS-CoV-2) virus continually led to infect a large population worldwide. SARS-CoV-2 …
Theoretical insights into the anti-SARS-CoV-2 activity of chloroquine and its analogs and in silico screening of main protease inhibitors
AS Achutha, VL Pushpa, S Suchitra - Journal of proteome …, 2020 - ACS Publications
… and hydroxychloroquine, against SARS-CoV-2 virus. These … that show drug likeness toward
SARS-CoV-2 that can be … There have been reports about the entry of SARS coronavirus …
SARS-CoV-2 that can be … There have been reports about the entry of SARS coronavirus …
In silico virtual screening, characterization, docking and molecular dynamics studies of crucial SARS-CoV-2 proteins
M Alazmi, O Motwalli - Journal of Biomolecular Structure and …, 2021 - Taylor & Francis
… We chose important proteins from the SARS-CoV-2 genome … -ligand complex provides
the insights that Baicalin has a … to the receptor binding domain of SARS-CoV-2). Our studies …
the insights that Baicalin has a … to the receptor binding domain of SARS-CoV-2). Our studies …
[HTML][HTML] A closer look at dexamethasone and the SARS-CoV-2-induced cytokine storm: in silico insights of the first life-saving COVID-19 drug
P Morgan, SJ Arnold, NW Hsiao, CW Shu - Antibiotics, 2021 - mdpi.com
… repurposed therapeutic agent against SARS-CoV-2 infections. Our findings demonstrated
that dexamethasone exhibited significant binding affinity for two critical SARS-CoV-2 proteins, …
that dexamethasone exhibited significant binding affinity for two critical SARS-CoV-2 proteins, …
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