WizePairZ: A Novel Algorithm to Identify, Encode, and Exploit Matched Molecular Pairs with Unspecified Cores in Medicinal Chemistry.
Daniel J. WarnerEdward J. GriffenStephen A. St-GallayPublished in: J. Chem. Inf. Model. (2010)
Keyphrases
- times faster
- learning algorithm
- similarity measure
- objective function
- computational complexity
- preprocessing
- matching algorithm
- computational cost
- probabilistic model
- tree structure
- high accuracy
- recognition algorithm
- convergence rate
- classification algorithm
- detection algorithm
- input data
- significant improvement
- theoretical analysis
- segmentation algorithm
- optimization algorithm
- linear programming
- data sets
- dynamic programming
- pairwise
- data structure
- three dimensional
- improved algorithm