Coupled atomic charge selectivity for optimal ligand-charge distributions at protein binding sites.
Sathesh BhatTraian SuleaEnrico O. PurisimaPublished in: J. Comput. Chem. (2006)
Keyphrases
- binding sites
- protein protein
- virtual screening
- dna binding
- sequence alignment
- dna sequences
- gene expression
- protein protein interactions
- sequence data
- protein interaction
- regulatory elements
- transcription factors
- computational methods
- protein structure
- protein sequences
- predicting protein
- transcription factor binding sites
- biological sequences
- drosophila melanogaster
- statistical significance
- high throughput
- interaction networks
- motif discovery
- protein function
- drug discovery
- influenza virus
- biological processes
- protein families
- drug design
- worst case
- amino acid sequences
- protein complexes
- protein structure prediction
- pairwise