Autoencoding undirected molecular graphs with neural networks.
Jeppe Johan Waarkjær OlsenPeter Ebert ChristensenMartin Hangaard HansenAlexander Rosenberg JohansenPublished in: CoRR (2020)
Keyphrases
- neural network
- directed graph
- weighted graph
- undirected graph
- pattern recognition
- graph matching
- artificial neural networks
- three dimensional
- multi layer
- neural network model
- graph theoretic
- random graphs
- back propagation
- graph theory
- graph databases
- graph partitioning
- graph construction
- molecular structure
- graph model
- graph mining
- directed acyclic graph
- neural nets
- associative memory
- connected components
- fault diagnosis
- random walk
- pairwise