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Connected Subgraph Fingerprints: Representing Molecules Using Exhaustive Subgraph Enumeration

Louis Bellmann1, Patrick Penner1, Matthias Rarey1

  • 1Universität Hamburg , ZBH - Center for Bioinformatics, Research Group for Computational Molecular Design , Bundesstraße 43 , 20146 Hamburg , Germany.

Journal of Chemical Information and Modeling
|October 26, 2019
PubMed

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