Drug repurposing based on a quantum-inspired method versus classical fingerprinting uncovers potential antivirals against SARS-CoV-2

The COVID-19 pandemic has accelerated the need to identify new antiviral therapeutics at pace, including through drug repurposing. We employed a Quadratic Unbounded Binary Optimization (QUBO) model, to search for compounds similar to Remdesivir, the first antiviral against SARS-CoV-2 approved for hu...

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Detalles Bibliográficos
Autores principales: Jimenez-Guardeño, Jose M., Ortega-Prieto, Ana Maria, Menendez Moreno, Borja, Maguire, Thomas J. A., Richardson, Adam, Diaz-Hernandez, Juan Ignacio, Diez Perez, Javier, Zuckerman, Mark, Mercadal Playa, Albert, Cordero Deline, Carlos, Malim, Michael H., Martinez-Nunez, Rocio Teresa
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2022
Materias:
Research Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9333455/
https://www.ncbi.nlm.nih.gov/pubmed/35849631
http://dx.doi.org/10.1371/journal.pcbi.1010330

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9333455/
https://www.ncbi.nlm.nih.gov/pubmed/35849631
http://dx.doi.org/10.1371/journal.pcbi.1010330

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