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On the Basis of Invariants of Labeled Molecular Graphs.
Igor I. Baskin
Mariya I. Skvortsova
Ivan V. Stankevich
Nikolai S. Zefirov
Published in:
J. Chem. Inf. Comput. Sci. (1995)
Keyphrases
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labeled graphs
training data
data sets
three dimensional
supervised learning
graph theory
graph theoretic
directed graph
bipartite graph
affine invariant
graph mining
undirected graph
subgraph isomorphism