Comparison of Two Methods for Predicting Aqueous Solubility.
Debra L. PetersonSamuel H. YalkowskyPublished in: J. Chem. Inf. Comput. Sci. (2001)
Keyphrases
- benchmark datasets
- machine learning methods
- cross validation
- data mining techniques
- computational cost
- preprocessing
- data sets
- significant improvement
- information systems
- artificial intelligence
- face recognition
- empirical studies
- machine learning
- data mining
- statistical models
- database
- constraint satisfaction
- computationally expensive
- qualitative and quantitative