Selection Rules for Outliers in Outlier Flooding Method Regulate Its Conformational Sampling Efficiency.
Ryuhei HaradaYasuteru ShigetaPublished in: J. Chem. Inf. Model. (2019)
Keyphrases
- high efficiency
- objective function
- pairwise
- significant improvement
- computational efficiency
- detection algorithm
- detection method
- high accuracy
- dynamic programming
- probabilistic model
- support vector machine
- computational cost
- support vector machine svm
- decision rules
- classification method
- cost function
- highly efficient
- computational complexity
- decision trees
- error rate
- selection algorithm
- random sampling
- sampling algorithm
- sampling methods