An efficient algorithm for the computation of the canonical numbering of reaction matrices.
Josef BrandtAnnette von ScholleyPublished in: Comput. Chem. (1983)
Keyphrases
- experimental evaluation
- improved algorithm
- objective function
- optimal solution
- k means
- detection algorithm
- computational cost
- learning algorithm
- times faster
- theoretical analysis
- worst case
- cost function
- neural network
- probabilistic model
- high accuracy
- linear programming
- memory efficient
- least squares
- np hard
- segmentation algorithm
- significant improvement
- clustering method
- tree structure
- search space
- convex hull
- convergence rate
- distance matrix