sc-PDB-Frag: A Database of Protein-Ligand Interaction Patterns for Bioisosteric Replacements.
Jérémy DesaphyDidier RognanPublished in: J. Chem. Inf. Model. (2014)
Keyphrases
- database
- interaction patterns
- protein structure
- databases
- drug design
- protein structure prediction
- data sets
- drug discovery
- information retrieval
- data model
- protein protein
- social network analysis
- virtual screening
- secondary structure
- amino acids
- social interaction
- multi dimensional
- metadata
- learning algorithm
- machine learning