Reverse mapping method for complex polymer systems.
Jakub KrajniakZidan ZhangSudharsan PandiyanEric NiesGiovanni SamaeyPublished in: J. Comput. Chem. (2018)
Keyphrases
- high precision
- high accuracy
- main contribution
- preprocessing
- fully automatic
- synthetic data
- neural network
- support vector machine svm
- significant improvement
- experimental evaluation
- dynamic programming
- clustering method
- optimization algorithm
- classification accuracy
- detection method
- classification method
- evaluation method
- computationally efficient
- mutual information
- computational cost
- cost function
- prior knowledge
- pairwise
- computational complexity
- objective function
- high level
- machine learning
- real world