The Discovery of inhibitors of the SARS-CoV-2 S protein through computational drug repurposing.
Ana Isabel Avilés-AlíaJoao ZulaicaJuan Jesús PérezJaime Rubio-MartinezRon GellerJosé M. Granadino-RoldánPublished in: Comput. Biol. Medicine (2024)
Keyphrases
- drug discovery
- drug design
- virtual screening
- protein protein interactions
- knowledge discovery
- discovery process
- chemical compounds
- severe acute respiratory syndrome
- physico chemical
- protein functional
- protein structure prediction
- protein structure
- protein sequences
- scientific discovery
- public health
- amino acids
- subcellular localization
- pharmaceutical industry
- data mining