Connecting proteins with drug-like compounds: Open source drug discovery workflows with BindingDB and KNIME.
George NicolaMichael R. BertholdMichael P. HedrickMichael K. GilsonPublished in: Database J. Biol. Databases Curation (2015)
Keyphrases
- drug discovery
- open source
- chemical compounds
- drug design
- subcellular localization
- pharmaceutical industry
- mass spectrometry
- data processing
- virtual screening
- early stage
- discovery process
- data mining tools
- protein structure
- systems biology
- biological systems
- scientific data
- query processing
- data mining
- multi agent systems