Title of article :
The Suggestion of a Drug for COVID-19 with Molecular Docking
Author/Authors :
sabbaghzadeh ، reihaneh Department of Biology - Faculty of Sciences - Hakim Sabzevari University
From page :
39
To page :
44
Abstract :
Background and objectives: This study aimed to study the interaction between the severe acute respiratory syndrome coronavirus 2 (SARS‑CoV‑2) spike protein complex and seven drugs that inhibit the angiotensin-converting enzyme 2. Methods: Plots of protein-ligand interaction were obtained using the LigPlot software. In addition, binding energies in kcal/mol, hydrophobic interactions, and hydrogen bonds were determined. Autodock software v.1.5.6 and AutoDock Vina were used for the analysis of molecular docking processes. Results: The only structure that interacted with the SARS‑CoV‑2 spike protein was anakinra. Conclusion: Anakinra was the only drug that interacted with the SARS‑CoV‑2 spike protein. This could be further investigated for finding a temporary alternative medicine for the treatment of coronavirus disease 2019.
Keywords :
Molecular Docking Simulation , SARS , CoV , 2 , Software
Journal title :
Medical Laboratory Journal
Journal title :
Medical Laboratory Journal
Record number :
2752919
Link To Document :
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