Cyclic Peptides as Protein Kinase Inhibitors: Structure-Activity Relationship and Molecular Modeling.
Michel F. SannerKhalid ZoghebiSamara HannaSaghar MozaffariSimin RahighiRakesh K. TiwariKeykavous ParangPublished in: J. Chem. Inf. Model. (2021)
Keyphrases
- molecular structures
- hiv protease
- amino acids
- mass spectrometry
- physicochemical properties
- mass spectrometry data
- protein protein interactions
- drug discovery
- tertiary structure
- tandem mass spectra
- protein structure prediction
- drug design
- molecular dynamics
- contact map
- sequence alignment
- biological data
- protein sequences
- high throughput
- pairwise
- sequence analysis
- protein protein
- mass spectra
- chemical reactions
- ms ms
- structural properties
- pattern classification