Papers › Quantum-based subgraph convolutional neural networks

Quantum-based subgraph convolutional neural networks

1 Apr 2019Pattern Recognition 2019 4archive 2025-07-28

Zhihong Zhang, Dong-Dong Chen, Jianjia Wang, Lu Bai, Edwin R. Hancock

This paper proposes a new graph convolutional neural network architecture based on a depth-based representation of graph structure deriving from quantum walks, which we refer to as the quantum-based subgraph convolutional neural network (QS-CNNs). This new architecture captures both the global topological structure and the local connectivity structure within a graph. Specifically, we commence by establishing a family of K-layer expansion subgraphs for each vertex of a graph by quantum walks, which captures the global topological arrangement information for substructures contained within a graph. We then design a set of fixed-size convolution filters over the subgraphs, which helps to characterise multi-scale patterns residing in the data. The idea is to apply convolution filters sliding over the entire set of subgraphs rooted at a vertex to extract the local features analogous to the standard convolution operation on grid data. Experiments on eight graph-structured datasets demonstrate that QS-CNNs architecture is capable of outperforming fourteen state-of-the-art methods for the tasks of node classification and graph classification.

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Tasks

General ClassificationGraph ClassificationNode Classification

Results from the paper archive 2025-07-28

TaskDatasetModelMetricValueRank at snapshotLeaderboardReport
Graph Classification MUTAG QS-CNNs (Quantum Walk) Accuracy 93.13% #11 of 74 Archive leaderboard report
Graph Classification MUTAG QS-CNNs (Quantum Walk) Accuracy (10-fold) 93.13 #11 of 74 Archive leaderboard report
Graph Classification PROTEINS QS-CNNs (Quantum Walk) Accuracy 78.80% #14 of 103 Archive leaderboard report
Graph Classification PROTEINS DS-CNNs (Random Walk) Accuracy 78.35% #19 of 103 Archive leaderboard report

Ranks are positions in the archive's leaderboards as they stood at the 2025-07-28 snapshot. Results published since then are not among these rows, so a rank here is not a current standing.

Methods

Convolution

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