[HTML][HTML] Strain wars 2: Binding constants, enthalpies, entropies, Gibbs energies and rates of binding of SARS-CoV-2 variants

M Popovic - Virology, 2022 - Elsevier
… The aim of this paper is to calculate binding constants, as well as standard enthalpies,
entropies and Gibbs energies of binding of various SARS-CoV-2 strains. For the first time, the …

[HTML][HTML] … insight into viral infections 2: empirical formulas, molecular compositions and thermodynamic properties of SARS, MERS and SARS-CoV-2 (COVID-19) …

M Popovic, M Minceva - Heliyon, 2020 - cell.com
SARS, MERS and SARS-CoV-2 were found, as well as their standard thermodynamic properties
of formation and growth. Standard Gibbs energy … The ratio of Gibbs energies of growth …

Beyond COVID-19: Do biothermodynamic properties allow predicting the future evolution of SARS-CoV-2 variants?

M Popovic - Microbial risk analysis, 2022 - Elsevier
Gibbs energy of binding and Gibbs energy of growth. Based on analysis of biothermodynamic
parameters of various variants of SARS-CoV-2, SARS-CoV and MERS-CoV … of SARS-CoV-…

Strain Wars: Competitive interactions between SARS-CoV-2 strains are explained by Gibbs energy of antigen-receptor binding

M Popovic, M Popovic - Microbial risk analysis, 2022 - Elsevier
… Infectivity of SARS-CoV-2 strains depends on binding affinity of the virus to its host cell …
affinity using Gibbs energy of binding and analyzed the competition between SARS-CoV-2 strains …

[HTML][HTML] Strain Wars 4-Darwinian evolution through Gibbs' glasses: Gibbs energies of binding and growth explain evolution of SARS-CoV-2 from Hu-1 to BA. 2

M Popovic - Virology, 2022 - Elsevier
… It is concluded that SARS-CoV-2 has evolved by making its Gibbs energy of binding … in
Gibbs energy of binding plays the major role in SARS-CoV-2 evolution. Therefore, Gibbs energy

Synthesis, molecular docking, and binding Gibbs free energy calculation of β-nitrostyrene derivatives: Potential inhibitors of SARS-CoV-2 3CL protease

Z Jia, X Lan, K Lu, X Meng, W Jing, S Jia, K Zhao… - Journal of Molecular …, 2023 - Elsevier
… of ligand-receptor binding Gibbs free energy [69,70]. Due to … Gibbs free energy, we adopted
the process-based software BAT.py to simplify the process of the binding Gibbs free energy

Never ending story? Evolution of SARS-CoV-2 monitored through Gibbs energies of biosynthesis and antigen-receptor binding of Omicron BQ. 1, BQ. 1.1, XBB and …

M Popovic - Microbial risk analysis, 2023 - Elsevier
… In this research, standard Gibbs energies of binding of the new SARS-CoV-2 variants were
found to be: -52.55 for the BQ.1 variant, -52.81 kJ/mol for the BQ.1.1 variant, -49.65 kJ/mol for …

[HTML][HTML] XBB. 1.5 Kraken cracked: Gibbs energies of binding and biosynthesis of the XBB. 1.5 variant of SARS-CoV-2

ME Popovic - Microbiological research, 2023 - Elsevier
… in SARS-CoV-2 evolution towards more negative Gibbs energy of binding and tendency
towards mildly negative Gibbs energy … acquisition of mutations by SARS-CoV-2. Replacement of …

[HTML][HTML] … . 2.75 subvariant of SARS-CoV-2 is expected to have the greatest infectivity compared with the competing BA. 2 and BA. 5, due to most negative Gibbs energy …

M Popovic - BioTech, 2022 - mdpi.com
… in spike protein and other genes of SARS-CoV-2 than any other variant… Gibbs energy of the
binding and antigen-receptor binding rate was reported for the BA.2.75 variant. Gibbs energy

Strain Wars 5: Gibbs energies of binding of BA. 1 through BA. 4 variants of SARS-CoV-2

M Popovic - Microbial risk analysis, 2022 - Elsevier
Gibbs energies of binding of the BA.1, BA.2, BA.3, BA.2.13, BA.2.12.1 and BA.4 Omicron
variants of SARS-CoV-2, to … a trend of decreasing standard Gibbs energy of binding and hence …