Search Results - "Automorphism"
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Canonization, Morgan algorithm, equivalence classes
Published 2011Table of Contents: “…-- Basic definitions: permutation, symmetric group, automorphism -- Applications and implementations of canonizers -- Morgan Algorithm -- General strategies: initial classification, iterative refinement, labeling by backtracking, pruning the backtrack tree, profiting from symmetry -- Symmetrically equivalent atoms -- Outlook: equivalence classes of molecular graphs.…”
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