Research Article
[Retracted] Computational Study on the Inhibitory Effect of Natural Compounds against the SARS-CoV-2 Proteins
Table 1
Glide score and glide energy of homeopathy compounds with SARS-CoV-2 structural and nonstructural proteins.
| Structural protein | Plant name | Compound ID | Glide score (kcal/mol) | Glide energy (kcal/mol) |
| Spike protein (PDB: ID 7BZ5) | Arnica flowers | 3802778 | −7.929 | −47.657 | Membrane protein | Arnica flowers | 320361 | −5.636 | −37.056 |
| Nonstructural protein | Plant name | Compound ID | GLIDE score (kcal/mol) | Glide energy (kcal/mol) | Nsp14 (PDB: ID 5C8S) | | Arnica flowers | 3802778 | −9.583 | −57.967 | Arnica flowers | 5315832 | −7.672 | −40.340 | Nsp13 (PDB: ID 5WWP) | Pulsatila | 14590080 | −13.631 | −75.093 | Pulsatila | 74029795 | −11.957 | −71.614 | Main protease (PDB: ID 6LU7)1 | Pulsatila | 74029795 | −10.970 | −61.272 | Nsp15 (PDB: ID 6X4I) | Arnica flowers | 3802778 | −10.902 | −59.517 | Nsp12 (PDB: ID 6XQB) | Arnica flowers | 320361 | −8.637 | −37.064 |
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