Molecular tailoring approach in conjunction with MP2 and Ri-MP2 codes: A comparison with fragment molecular orbital method.
Anuja P. RahalkarMichio KatoudaShridhar R. GadreShigeru NagasePublished in: J. Comput. Chem. (2010)
Keyphrases
- high accuracy
- experimental evaluation
- detection method
- neural network
- similarity measure
- objective function
- pairwise
- high precision
- cost function
- segmentation method
- mutual information
- computationally efficient
- synthetic data
- clustering method
- error correction
- detection algorithm
- optimization algorithm
- support vector machine
- significant improvement
- machine learning