Cargando…
Natural inhibitors of SARS-CoV-2 main protease: structure based pharmacophore modeling, molecular docking and molecular dynamic simulation studies
Main protease (M(pro)) plays a key role in replication of severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2). This study was designed for finding natural inhibitors of SARS-CoV-2 M(pro) by in silico methods. To this end, the co-crystal structure of M(pro) with telaprevir was explored and r...
| Autores principales: | , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer Berlin Heidelberg
2022
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9420677/ https://www.ncbi.nlm.nih.gov/pubmed/36031629 http://dx.doi.org/10.1007/s00894-022-05286-6 |