Extending rule-based methods to model molecular geometry.
Brittany R. HoardBruna JacobsonKasra ManaviLydia TapiaPublished in: BIBM (2015)
Keyphrases
- high level
- benchmark datasets
- monte carlo simulation
- prediction model
- formal model
- qualitative and quantitative
- mathematical model
- probabilistic model
- three dimensional
- computational cost
- data sets
- cost function
- statistical model
- conceptual model
- linear regression
- mathematical models
- probability distribution
- em algorithm
- classification method
- significant improvement
- expert systems
- preprocessing