We present our ongoing work on understanding the limitations of graph convolutional networks (GCNs) as well as our work on generalizations of graph convolutions for representing more complex node attribute dependencies. Based on an analysis of GCNs with the help of the corresponding computation graphs, we propose a generalization of existing GCNs where the aggregation operations are (a) determined by structural properties of the local neighborhood graphs and (b) not restricted to weighted averages. We show that the proposed approach is strictly more expressive while requiring only a modest increase in the number of parameters and computations. We also show that the proposed generalization is identical to standard convolutional layers when applied to regular grid graphs.
There has been a large number of methods for learning graph representations. These include not only approaches to the node classification problem @cite_1 @cite_19 @cite_17 @cite_7 @cite_0 but also approaches for the problem of classifying entire graphs @cite_6 @cite_4 @cite_12 @cite_20 @cite_13 @cite_9 . With our work we focus on the problem of node representation learning and, specifically, graph convolutional networks applied to this problem.
@cite_4 @cite_7 @cite_9 @cite_1 @cite_6 @cite_0 @cite_19 @cite_20 @cite_13 @cite_12 @cite_17
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Recently, graph neural networks (GNNs) have revolutionized the field of graph representation learning through effectively learned node embeddings, and achieved state-of-the-art results in tasks such as node classification and link prediction. However, current GNN methods are inherently flat and do not learn hierarchical representations of graphs---a limitation that is especially problematic for the task of graph classification, where the goal is to predict the label associated with an entire graph. Here we propose DiffPool, a differentiable graph pooling module that can generate hierarchical representations of graphs and can be combined with various graph neural network architectures in an end-to-end fashion. DiffPool learns a differentiable soft cluster assignment for nodes at each layer of a deep GNN, mapping nodes to a set of clusters, which then form the coarsened input for the next GNN layer. Our experimental results show that combining existing GNN methods with DiffPool yields an average improvement of 5-10 accuracy on graph classification benchmarks, compared to all existing pooling approaches, achieving a new state-of-the-art on four out of five benchmark datasets. Recently, graph neural networks (GNNs) have revolutionized the field of graph representation learning through effectively learned node embeddings, and achieved state-of-the-art results in tasks such as node classification and link prediction. However, current GNN methods are inherently flat and do not learn hierarchical representations of graphs---a limitation that is especially problematic for the task of graph classification, where the goal is to predict the label associated with an entire graph. Here we propose DiffPool, a differentiable graph pooling module that can generate hierarchical representations of graphs and can be combined with various graph neural network architectures in an end-to-end fashion. DiffPool learns a differentiable soft cluster assignment for nodes at each layer of a deep GNN, mapping nodes to a set of clusters, which then form the coarsened input for the next GNN layer. Our experimental results show that combining existing GNN methods with DiffPool yields an average improvement of 5-10 accuracy on graph classification benchmarks, compared to all existing pooling approaches, achieving a new state-of-the-art on four out of five benchmark data sets. Recently a variety of methods have been developed to encode graphs into low-dimensional vectors that can be easily exploited by machine learning algorithms. The majority of these methods start by embedding the graph nodes into a low-dimensional vector space, followed by using some scheme to aggregate the node embeddings. In this work, we develop a new approach to learn graph-level representations, which includes a combination of unsupervised and supervised learning components. We start by learning a set of node representations in an unsupervised fashion. Graph nodes are mapped into node sequences sampled from random walk approaches approximated by the Gumbel-Softmax distribution. Recurrent neural network (RNN) units are modified to accommodate both the node representations as well as their neighborhood information. Experiments on standard graph classification benchmarks demonstrate that our proposed approach achieves superior or comparable performance relative to the state-of-the-art algorithms in terms of convergence speed and classification accuracy. We further illustrate the effectiveness of the different components used by our approach. Graph classification is a problem with practical applications in many different domains. To solve this problem, one usually calculates certain graph statistics (i.e., graph features) that help discriminate between graphs of different classes. When calculating such features, most existing approaches process the entire graph. In a graphlet-based approach, for instance, the entire graph is processed to get the total count of different graphlets or subgraphs. In many real-world applications, however, graphs can be noisy with discriminative patterns confined to certain regions in the graph only. In this work, we study the problem of attention-based graph classification. The use of attention allows us to focus on small but informative parts of the graph, avoiding noise in the rest of the graph. We present a novel RNN model, called the Graph Attention Model (GAM), that processes only a portion of the graph by adaptively selecting a sequence of "informative" nodes. Experimental results on multiple real-world datasets show that the proposed method is competitive against various well-known methods in graph classification even though our method is limited to only a portion of the graph.