S···O and S···N Sulfur Bonding Interactions in Protein-Ligand Complexes: Empirical Considerations and Scoring Function.
Mathew R. KoebelAaron CooperGrant SchmadekeSoyoung JeonMahesh NarayanSuman SirimullaPublished in: J. Chem. Inf. Model. (2016)
Keyphrases
- scoring function
- virtual screening
- protein protein
- protein complexes
- protein protein interactions
- scoring functions
- structure learning
- interaction networks
- computational methods
- drug discovery
- binding sites
- protein interaction networks
- protein sequences
- high throughput
- ranking functions
- protein interaction
- computational biology
- functional modules
- protein function
- machine learning
- similarity searching
- protein structure
- drug design