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Graph representations of molecular similarity measures based on topological resolution.
Paul G. Mezey
Published in:
J. Comput. Methods Sci. Eng. (2005)
Keyphrases
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graph representations
similarity measure
graph structure
graph theory
graph representation
feature vectors
similarity search
connected components
graph kernels
distance measure
euclidean distance
edit distance
learning algorithm
training data
support vector
clustering method
distance function
semantic similarity