Low-dimensional embeddings of nodes in large graphs have proved extremely useful in a variety of prediction tasks, from content recommendation to identifying protein functions. However, most existing approaches require that all nodes in the graph are present during training of the embeddings; these previous approaches are inherently transductive and do not naturally generalize to unseen nodes. Here we present GraphSAGE, a general, inductive framework that leverages node feature information (e.g., text attributes) to efficiently generate node embeddings for previously unseen data. Instead of training individual embeddings for each node, we learn a function that generates embeddings by sampling and aggregating features from a node's local neighborhood. Our algorithm outperforms strong baselines on three inductive node-classification benchmarks: we classify the category of unseen nodes in evolving information graphs based on citation and Reddit post data, and we show that our algorithm generalizes to completely unseen graphs using a multi-graph dataset of protein-protein interactions.

Inductive Representation Learning on Large Graphs

Deep learning has revolutionized many machine learning tasks in recent years, ranging from image classification and video processing to speech recognition and natural language understanding. The data in these tasks are typically represented in the Euclidean space. However, there is an increasing number of applications, where data are generated from non-Euclidean domains and are represented as graphs with complex relationships and interdependency between objects. The complexity of graph data has imposed significant challenges on the existing machine learning algorithms. Recently, many studies on extending deep learning approaches for graph data have emerged. In this article, we provide a comprehensive overview of graph neural networks (GNNs) in data mining and machine learning fields. We propose a new taxonomy to divide the state-of-the-art GNNs into four categories, namely, recurrent GNNs, convolutional GNNs, graph autoencoders, and spatial–temporal GNNs. We further discuss the applications of GNNs across various domains and summarize the open-source codes, benchmark data sets, and model evaluation of GNNs. Finally, we propose potential research directions in this rapidly growing field.

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A Comprehensive Survey on Graph Neural Networks

Lots of learning tasks require dealing with graph data which contains rich relation information among elements. Modeling physics systems, learning molecular fingerprints, predicting protein interface, and classifying diseases demand a model to learn from graph inputs. In other domains such as learning from non-structural data like texts and images, reasoning on extracted structures (like the dependency trees of sentences and the scene graphs of images) is an important research topic which also needs graph reasoning models. Graph neural networks (GNNs) are neural models that capture the dependence of graphs via message passing between the nodes of graphs. In recent years, variants of GNNs such as graph convolutional network (GCN), graph attention network (GAT), graph recurrent network (GRN) have demonstrated ground-breaking performances on many deep learning tasks. In this survey, we propose a general design pipeline for GNN models and discuss the variants of each component, systematically categorize the applications, and propose four open problems for future research.

Graph Neural Networks: A Review of Methods and Applications

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Neural Networks and Deep Learning

Network embedding is an important method to learn low-dimensional representations of vertexes in networks, aiming to capture and preserve the network structure. Almost all the existing network embedding methods adopt shallow models. However, since the underlying network structure is complex, shallow models cannot capture the highly non-linear network structure, resulting in sub-optimal network representations. Therefore, how to find a method that is able to effectively capture the highly non-linear network structure and preserve the global and local structure is an open yet important problem. To solve this problem, in this paper we propose a Structural Deep Network Embedding method, namely SDNE. More specifically, we first propose a semi-supervised deep model, which has multiple layers of non-linear functions, thereby being able to capture the highly non-linear network structure. Then we propose to exploit the first-order and second-order proximity jointly to preserve the network structure. The second-order proximity is used by the unsupervised component to capture the global network structure. While the first-order proximity is used as the supervised information in the supervised component to preserve the local network structure. By jointly optimizing them in the semi-supervised deep model, our method can preserve both the local and global network structure and is robust to sparse networks. Empirically, we conduct the experiments on five real-world networks, including a language network, a citation network and three social networks. The results show that compared to the baselines, our method can reconstruct the original network significantly better and achieves substantial gains in three applications, i.e. multi-label classification, link prediction and visualization.

Structural Deep Network Embedding

With the rapid growth of financial services, fraud detection has been a very important problem to guarantee a healthy environment for both users and providers. Conventional solutions for fraud detection mainly use some rule-based methods or distract some features manually to perform prediction. However, in financial services, users have rich interactions and they themselves always show multifaceted information. These data form a large multiview network, which is not fully exploited by conventional methods. Additionally, among the network, only very few of the users are labelled, which also poses a great challenge for only utilizing labeled data to achieve a satisfied performance on fraud detection. To address the problem, we expand the labeled data through their social relations to get the unlabeled data and propose a semi-supervised attentive graph neural network, named SemiGNN to utilize the multi-view labeled and unlabeled data for fraud detection. Moreover, we propose a hierarchical attention mechanism to better correlate different neighbors and different views. Simultaneously, the attention mechanism can make the model interpretable and tell what are the important factors for the fraud and why the users are predicted as fraud. Experimentally, we conduct the prediction task on the users of Alipay, one of the largest third-party online and offline cashless payment platform serving more than 4 hundreds of million users in China. By utilizing the social relations and the user attributes, our method can achieve a better accuracy compared with the state-of-the-art methods on two tasks. Moreover, the interpretable results also give interesting intuitions regarding the tasks.

A Semi-Supervised Graph Attentive Network for Financial Fraud Detection

With the rapid growth of financial services, fraud detection has been a very important problem to guarantee a healthy environment for both users and providers. Conventional solutions for fraud detection mainly use some rule-based methods or distract some features manually to perform prediction. However, in financial services, users have rich interactions and they themselves always show multifaceted information. These data form a large multiview network, which is not fully exploited by conventional methods. Additionally, among the network, only very few of the users are labelled, which also poses a great challenge for only utilizing labeled data to achieve a satisfied performance on fraud detection. 
To address the problem, we expand the labeled data through their social relations to get the unlabeled data and propose a semi-supervised attentive graph neural network, namedSemiGNN to utilize the multi-view labeled and unlabeled data for fraud detection. Moreover, we propose a hierarchical attention mechanism to better correlate different neighbors and different views. Simultaneously, the attention mechanism can make the model interpretable and tell what are the important factors for the fraud and why the users are predicted as fraud. Experimentally, we conduct the prediction task on the users of Alipay, one of the largest third-party online and offline cashless payment platform serving more than 4 hundreds of million users in China. By utilizing the social relations and the user attributes, our method can achieve a better accuracy compared with the state-of-the-art methods on two tasks. Moreover, the interpretable results also give interesting intuitions regarding the tasks.

A Semi-supervised Graph Attentive Network for Financial Fraud Detection

Network embedding, aiming to embed a network into a low dimensional vector space while preserving the inherent structural properties of the network, has attracted considerable attentions recently. Most of the existing embedding methods embed nodes as point vectors in a low-dimensional continuous space. In this way, the formation of the edge is deterministic and only determined by the positions of the nodes. However, the formation and evolution of real-world networks are full of uncertainties, which makes these methods not optimal. To address the problem, we propose a novel Deep Variational Network Embedding in Wasserstein Space (DVNE) in this paper. The proposed method learns a Gaussian distribution in the Wasserstein space as the latent representation of each node, which can simultaneously preserve the network structure and model the uncertainty of nodes. Specifically, we use 2-Wasserstein distance as the similarity measure between the distributions, which can well preserve the transitivity in the network with a linear computational cost. Moreover, our method implies the mathematical relevance of mean and variance by the deep variational model, which can well capture the position of the node by the mean vectors and the uncertainties of nodes by the variance. Additionally, our method captures both the local and global network structure by preserving the first-order and second-order proximity in the network. Our experimental results demonstrate that our method can effectively model the uncertainty of nodes in networks, and show a substantial gain on real-world applications such as link prediction and multi-label classification compared with the state-of-the-art methods.

Deep Variational Network Embedding in Wasserstein Space

Hashing is an important method for performing efficient similarity search. With the explosive growth of multimodal data, how to learn hashing-based compact representations for multimodal data becomes highly non-trivial. Compared with shallow-structured models, deep models present superiority in capturing multimodal correlations due to their high nonlinearity. However, in order to make the learned representation more accurate and compact, how to reduce the redundant information lying in the multimodal representations and incorporate different complexities of different modalities in the deep models is still an open problem. In this paper, we propose a novel deep multimodal hashing method, namely Deep Multimodal Hashing with Orthogonal Regularization (DMHOR), which fully exploits intra-modality and inter-modality correlations. In particular, to reduce redundant information, we impose orthogonal regularizer on the weighting matrices of the model, and theoretically prove that the learned representation is guaranteed to be approximately orthogonal. Moreover, we find that a better representation can be attained with different numbers of layers for different modalities, due to their different complexities. Comprehensive experiments on WIKI and NUS-WIDE, demonstrate a substantial gain of DMHOR compared with state-of-the-art methods.

Daixin Wang

Papers

Structural Deep Network Embedding

A Semi-Supervised Graph Attentive Network for Financial Fraud Detection

A Semi-supervised Graph Attentive Network for Financial Fraud Detection

Deep Variational Network Embedding in Wasserstein Space

Deep multimodal hashing with orthogonal regularization