Application of the PM6 semi-empirical method to modeling proteins enhances docking accuracy of AutoDock.
Zsolt BikádiEszter HazaiPublished in: J. Cheminformatics (2009)
Keyphrases
- high accuracy
- high precision
- experimental evaluation
- error rate
- classification accuracy
- similarity measure
- computational cost
- modeling method
- detection method
- learning algorithm
- average error
- synthetic data
- significant improvement
- theoretical analysis
- segmentation method
- classification method
- bayesian networks
- computational efficiency
- window size
- training data
- data sets