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Molecular Dynamic Simulation Search for Possible Amphiphilic Drug Discovery for Covid-19
To determine whether quaternary ammonium (k21) binds to Severe Acute Respiratory Syndrome–Coronavirus 2 (SARS-CoV-2) spike protein via computational molecular docking simulations, the crystal structure of the SARS-CoV-2 spike receptor-binding domain complexed with ACE-2 (PDB ID: 6LZG) was downloaded...
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| Publicado en: | Molecules |
|---|---|
| Autores principales: | , , , , |
| Formato: | Artigo |
| Lenguaje: | Inglês |
| Publicado: |
MDPI
2021
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| Materias: | |
| Acceso en línea: | https://ncbi.nlm.nih.gov/pmc/articles/PMC8069104/ https://ncbi.nlm.nih.gov/pubmed/33921378 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26082214 |
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