List operations on chemical graphs. 3. Development of vertex and edge models for fitting retention index data.
C. DuvenbeckPeter ZinnPublished in: J. Chem. Inf. Comput. Sci. (1993)
Keyphrases
- data analysis
- database
- data collection
- data sets
- raw data
- prior knowledge
- probabilistic model
- data structure
- statistical methods
- experimental data
- missing data
- software engineering
- accurate models
- learned models
- training data
- database systems
- data processing
- knowledge discovery
- probability distribution
- complex structures
- model fitting
- case study
- data representations