Binding and Unbinding Pathways of Peptide Substrates on the SARS-CoV-2 3CL Protease.
Kei MoritsuguToru EkimotoMitsunori IkeguchiAkinori KideraPublished in: J. Chem. Inf. Model. (2023)
Keyphrases
- hiv protease
- drug resistance
- coarse grained
- fine grained
- protein protein interactions
- human immunodeficiency virus
- sequence analysis
- severe acute respiratory syndrome
- high density
- linear support vector machines
- public health
- biological pathways
- thin film
- protein sequences
- high throughput
- mass spectrometry
- room temperature
- biologically inspired
- neural network
- amino acids
- tandem mass spectra
- structural properties