Data Mining and Machine Learning Techniques for the Identification of Mutagenicity Inducing Substructures and Structure Activity Relationships of Noncongeneric Compounds.
Christoph HelmaTobias CramerStefan KramerLuc De RaedtPublished in: J. Chem. Inf. Model. (2004)
Keyphrases
- data mining
- machine learning
- structural patterns
- chemical compounds
- data mining methods
- semantic structure
- machine learning algorithms
- pattern discovery
- data structure
- structural information
- decision trees
- drug discovery
- data mining tools
- web intelligence
- data mining applications
- human activities
- web mining
- tree structure
- decision support
- data warehouse
- knowledge discovery
- data analysis