Three-body expansion of the fragment molecular orbital method combined with density-functional tight-binding.
Yoshio NishimotoDmitri G. FedorovPublished in: J. Comput. Chem. (2017)
Keyphrases
- significant improvement
- dynamic programming
- synthetic data
- high accuracy
- segmentation method
- detection method
- clustering method
- cost function
- objective function
- optimization algorithm
- computationally efficient
- feature set
- experimental evaluation
- classification accuracy
- support vector machine
- computational cost
- model selection
- prior knowledge
- k means
- pairwise
- lower bound
- preprocessing
- human body
- image sequences