Journals
Publish with us
Publishing partnerships
About us
Blog
Cellular Microbiology
Journal overview
For authors
For reviewers
For editors
Table of Contents
Special Issues
Cellular Microbiology
/
2024
/
Article
/
Tab 6
/
Research Article
Molecular Docking, Dynamics Simulations, ADMET, and DFT Calculations: Combined
In Silico
Approach to Screen Natural Inhibitors of 3CL and PL Proteases of SARS-CoV-2
Table 6
Electron density maps of ligands.
Compound
DFT optimized structure
HOMO
LUMO
Glycyrrhizin
Rutin
Naringin
Violaxanthin