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Quantum simulations of SARS-CoV-2 main protease M(pro) enable high-quality scoring of diverse ligands
The COVID-19 pandemic has led to unprecedented efforts to identify drugs that can reduce its associated morbidity/mortality rate. Computational chemistry approaches hold the potential for triaging potential candidates far more quickly than their experimental counterparts. These methods have been wid...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer International Publishing
2021
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8321885/ https://www.ncbi.nlm.nih.gov/pubmed/34328586 http://dx.doi.org/10.1007/s10822-021-00412-7 |