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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Detalles Bibliográficos
Autores principales: Daood, Umer, Gopinath, Divya, Pichika, Malikarjuna Rao, Mak, Kit-Kay, Seow, Liang Lin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8069104/
https://www.ncbi.nlm.nih.gov/pubmed/33921378
http://dx.doi.org/10.3390/molecules26082214

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8069104/
https://www.ncbi.nlm.nih.gov/pubmed/33921378
http://dx.doi.org/10.3390/molecules26082214

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