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3CL(pro) and PL(pro) affinity, a docking study to fight COVID19 based on 900 compounds from PubChem and literature. Are there new drugs to be found?
The spread of a novel coronavirus SARS-CoV-2 and a resulting COVID19 disease in late 2019 has transformed into a worldwide pandemic and has effectively brought the world to a halt. Proteases 3CL(pro) and PL(pro), responsible for proteolysis of new virions, represent vital inhibition targets for the...
Autores principales: | Štekláč, Marek, Zajaček, Dávid, Bučinský, Lukáš |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Elsevier B.V.
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8238401/ https://www.ncbi.nlm.nih.gov/pubmed/34219808 http://dx.doi.org/10.1016/j.molstruc.2021.130968 |
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