An Efficient Algorithm for Automating Classification of Chemical Reactions into Classes in Ugi's Reaction Scheme.
Sanjay RamSomnath PalPublished in: Int. J. Chemoinformatics Chem. Eng. (2012)
Keyphrases
- classification scheme
- classification algorithm
- preprocessing
- learning algorithm
- probabilistic model
- significant improvement
- objective function
- classification method
- search space
- pattern recognition
- optimization algorithm
- k means
- detection algorithm
- optimal solution
- multi class classification
- data sets
- neural network
- recognition algorithm
- computationally efficient
- cost function
- decision trees
- computational complexity
- support vector
- machine learning
- computational cost
- accuracy rate
- genetic algorithm
- extracted features
- selection algorithm
- matching algorithm
- training set
- segmentation algorithm
- support vector machine svm
- np hard
- worst case
- semi supervised