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Are VAEs Bad at Reconstructing Molecular Graphs?
Hagen Muenkler
Hubert Misztela
Michal Pikusa
Marwin H. S. Segler
Nadine Schneider
Krzysztof Maziarz
Published in:
CoRR (2023)
Keyphrases
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graph theoretic
three dimensional
graph theory
graph matching
graph databases
random graphs
structured objects
series parallel
neural network
graph structure
graph mining
graph representation
drug discovery
dynamic graph
molecular structure
van der waals