A new algorithm for selection of synthetically important rings. The essential set of essential rings for organic structures.
Shinsaku FujitaPublished in: J. Chem. Inf. Comput. Sci. (1988)
Keyphrases
- selection algorithm
- detection algorithm
- preprocessing
- learning algorithm
- computationally efficient
- conflict free
- improved algorithm
- experimental evaluation
- initial set
- optimal solution
- input pattern
- cost function
- simulated annealing
- dynamic programming
- worst case
- input data
- convex hull
- computational complexity
- decomposition algorithm
- np hard
- clustering method
- high accuracy
- segmentation algorithm
- matching algorithm
- solution space
- recognition algorithm
- nearest neighbour
- theoretical analysis
- expectation maximization
- maximum likelihood