Similarity Approach to Chemical Reactivity. Overlap Determinant Method in the Chemistry of Complex Reactions with Coarctate Transition States.
Robert PonecPublished in: J. Chem. Inf. Comput. Sci. (1996)
Keyphrases
- similarity measure
- computational cost
- experimental evaluation
- pairwise
- dynamic programming
- similarity metric
- computationally efficient
- high accuracy
- prior knowledge
- computational complexity
- decision trees
- optimization algorithm
- synthetic data
- segmentation method
- high precision
- cost function
- high level
- feature set
- learning algorithm
- clustering method
- real world