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5 months ago

CKGConv: General Graph Convolution with Continuous Kernels

Liheng Ma; Soumyasundar Pal; Yitian Zhang; Jiaming Zhou; Yingxue Zhang; Mark Coates

CKGConv: General Graph Convolution with Continuous Kernels

Abstract

The existing definitions of graph convolution, either from spatial or spectral perspectives, are inflexible and not unified. Defining a general convolution operator in the graph domain is challenging due to the lack of canonical coordinates, the presence of irregular structures, and the properties of graph symmetries. In this work, we propose a novel and general graph convolution framework by parameterizing the kernels as continuous functions of pseudo-coordinates derived via graph positional encoding. We name this Continuous Kernel Graph Convolution (CKGConv). Theoretically, we demonstrate that CKGConv is flexible and expressive. CKGConv encompasses many existing graph convolutions, and exhibits a stronger expressiveness, as powerful as graph transformers in terms of distinguishing non-isomorphic graphs. Empirically, we show that CKGConv-based Networks outperform existing graph convolutional networks and perform comparably to the best graph transformers across a variety of graph datasets. The code and models are publicly available at https://github.com/networkslab/CKGConv.

Code Repositories

networkslab/ckgconv
Official
pytorch
Mentioned in GitHub

Benchmarks

BenchmarkMethodologyMetrics
graph-classification-on-cifar-10CKGCN
Accuracy: 72.785
graph-classification-on-mnistCKGCN
Accuracy: 98.423
graph-classification-on-peptides-funcCKGCN
AP: 0.6952
graph-regression-on-peptides-structCKGCN
MAE: 0.2477
graph-regression-on-zincCKGCN
MAE: 0.059
graph-regression-on-zinc-500kCKGCN
MAE: 5.9
node-classification-on-clusterCKGCN
Accuracy: 79.003
node-classification-on-patternCKGCN
Accuracy: 88.661

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CKGConv: General Graph Convolution with Continuous Kernels | Papers | HyperAI