However, existing graph neural networks (GNNs) fail to capture such an important property. To make GNN aware of automorphic equivalence, we first introduce a localized variant of this concept -- ego-centered automorphic equivalence (Ego-AE). Then, we design a novel variant of GNN,i.e., GRAPE, that uses learnable AE-aware aggregators to explicitly differentiate the Ego-AE ofeachnode'sneighbors withtheaidsofvarious subgraph templates.

Distinguishing the automorphic equivalence of nodes in a graph plays an essential role in many scientific domains, e.g., computational biologist and social network analysis. However, existing graph neural networks (GNNs) fail to capture such an important property. To make GNN aware of automorphic equivalence, we first introduce a localized variant of this concept --- ego-centered automorphic equivalence (Ego-AE). Then, we design a novel variant of GNN, i.e., GRAPE, that uses learnable AE-aware aggregators to explicitly differentiate the Ego-AE of each node's neighbors with the aids of various subgraph templates. While the design of subgraph templates can be hard, we further propose a genetic algorithm to automatically search them from graph data. Moreover, we theoretically prove that GRAPE is expressive in terms of generating distinct representations for nodes with different Ego-AE features, which fills in a fundamental gap of existing GNN variants. Finally, we empirically validate our model on eight real-world graph data, including social network, e-commerce co-purchase network, and citation network, and show that it consistently outperforms existing GNNs.

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However, existing graph neural networks (GNNs) fail to capture such an important property. To make GNN aware of automorphic equivalence, we first introduce a localized variant of this concept -- ego-centered automorphic equivalence (Ego-AE). Then, we design a novel variant of GNN, i.e., GRAPE, that uses learnable AE-aware aggregators to explicitly differentiate the Ego-AE

Distinguishing the automorphic equivalence of nodes in a graph plays an essential role in many scientific domains, e.g., computational biologist and social network analysis. However, existing graph neural networks (GNNs) fail to capture such an important property. To make GNN aware of automorphic equivalence, we first introduce a localized variant of this concept --- ego-centered automorphic equivalence (Ego-AE). Then, we design a novel variant of GNN, i.e., GRAPE, that uses learnable AE-aware aggregators to explicitly differentiate the Ego-AE of each node's neighbors with the aids of various subgraph templates. While the design of subgraph templates can be hard, we further propose a genetic algorithm to automatically search them from graph data.

Graph neural network (GNN) has recently been established as an effective representation learning framework on graph data. However, the popular message passing models rely on local permutation invariant aggregate functions, which gives rise to the concerns about their representational power. Here, we introduce the concept of automorphic equivalence to theoretically analyze GNN's expressiveness in differentiating node's structural role. We show that the existing message passing GNNs have limitations in learning expressive representations. Moreover, we design a novel GNN class that leverages learnable automorphic equivalence filters to explicitly differentiate the structural roles of each node's neighbors, and uses a squeeze-and-excitation module to fuse various structural information. We theoretically prove that the proposed model is expressive in terms of generating distinct representations for nodes with different structural feature. Besides, we empirically validate our model on eight real-world graph data, including social network, e-commerce co-purchase network and citation network, and show that it consistently outperforms strong baselines.

Deep learning models have achieved huge success in numerous fields, such as computer vision and natural language processing. However, unlike such fields, it is hard to apply traditional deep learning models on the graph data due to the `node-orderless' property. Normally, we use an adjacent matrix to represent a graph, but an artificial and random node-order will be cast on the graphs, which renders the performance of deep models extremely erratic and not robust. In order to eliminate the unnecessary node-order constraint, in this paper, we propose a novel model named Isomorphic Neural Network (IsoNN), which learns the graph representation by extracting its isomorphic features via the graph matching between input graph and templates. IsoNN has two main components: graph isomorphic feature extraction component and classification component. The graph isomorphic feature extraction component utilizes a set of subgraph templates as the kernel variables to learn the possible subgraph patterns existing in the input graph and then computes the isomorphic features. A set of permutation matrices is used in the component to break the node-order brought by the matrix representation. To further lower down the computational cost and identify the optimal subgraph patterns, IsoNN adopts two min-pooling layers to find the optimal matching. The first min-pooling layer aims at finding the best permutation matrix, whereas the second one is used to determine the best templates for the input graph data. Three fully-connected layers are used as the classification component in IsoNN. Extensive experiments are conducted on real-world datasets, and the experimental results demonstrate both the effectiveness and efficiency of IsoNN.