A hands-on guide to powerful graph-based deep learning models! Learn how to build cutting-edge graph neural networks for recommendation engines, molecular modeling, and more. Graph Neural Networks in Action teaches you to create powerful deep learning models for working with graph data. You’ll learn how to both design and train your models, and how to develop them into practical applications you can deploy to production. In Graph Neural Networks in Action you’ll create deep learning models that are perfect for working with interconnected graph data. Start with a comprehensive introduction to graph data’s unique properties. Then, dive straight into building real-world models, including GNNs that can generate node embeddings from a social network, recommend eCommerce products, and draw insights from social sites. This comprehensive guide contains coverage of the essential GNN libraries, including PyTorch Geometric, DeepGraph Library, and Alibaba’s GraphScope for training at scale. Purchase of the print book includes a free eBook in PDF, Kindle, and ePub formats from Manning Publications.

Deep Learning models are at the core of artificial intelligence research today. It is well known that deep learning techniques are disruptive for Euclidean data, such as images or sequence data, and not immediately applicable to graph-structured data such as text. This gap has driven a wave of research for deep learning on graphs, including graph representation learning, graph generation, and graph classification. The new neural network architectures on graph-structured data (graph neural networks, GNNs in short) have performed remarkably on these tasks, demonstrated by applications in social networks, bioinformatics, and medical informatics. Despite these successes, GNNs still face many challenges ranging from the foundational methodologies to the theoretical understandings of the power of the graph representation learning. This book provides a comprehensive introduction of GNNs. It first discusses the goals of graph representation learning and then reviews the history, current developments, and future directions of GNNs. The second part presents and reviews fundamental methods and theories concerning GNNs while the third part describes various frontiers that are built on the GNNs. The book concludes with an overview of recent developments in a number of applications using GNNs. This book is suitable for a wide audience including undergraduate and graduate students, postdoctoral researchers, professors and lecturers, as well as industrial and government practitioners who are new to this area or who already have some basic background but want to learn more about advanced and promising techniques and applications.

This book provides a comprehensive introduction to the basic concepts, models, and applications of graph neural networks. It starts with the introduction of the vanilla GNN model. Then several variants of the vanilla model are introduced such as graph convolutional networks, graph recurrent networks, graph attention networks, graph residual networks, and several general frameworks. Graphs are useful data structures in complex real-life applications such as modeling physical systems, learning molecular fingerprints, controlling traffic networks, and recommending friends in social networks. However, these tasks require dealing with non-Euclidean graph data that contains rich relational information between elements and cannot be well handled by traditional deep learning models (e.g., convolutional neural networks (CNNs) or recurrent neural networks (RNNs). Nodes in graphs usually contain useful feature information that cannot be well addressed in most unsupervised representation learning methods (e.g., network embedding methods). Graph neural networks (GNNs) are proposed to combine the feature information and the graph structure to learn better representations on graphs via feature propagation and aggregation. Due to its convincing performance and high interpretability, GNN has recently become a widely applied graph analysis tool. Variants for different graph types and advanced training methods are also included. As for the applications of GNNs, the book categorizes them into structural, non-structural, and other scenarios, and then it introduces several typical models on solving these tasks. Finally, the closing chapters provide GNN open resources and the outlook of several future directions.

Graph-structured data is ubiquitous throughout the natural and social sciences, from telecommunication networks to quantum chemistry. Building relational inductive biases into deep learning architectures is crucial for creating systems that can learn, reason, and generalize from this kind of data. Recent years have seen a surge in research on graph representation learning, including techniques for deep graph embeddings, generalizations of convolutional neural networks to graph-structured data, and neural message-passing approaches inspired by belief propagation. These advances in graph representation learning have led to new state-of-the-art results in numerous domains, including chemical synthesis, 3D vision, recommender systems, question answering, and social network analysis. This book provides a synthesis and overview of graph representation learning. It begins with a discussion of the goals of graph representation learning as well as key methodological foundations in graph theory and network analysis. Following this, the book introduces and reviews methods for learning node embeddings, including random-walk-based methods and applications to knowledge graphs. It then provides a technical synthesis and introduction to the highly successful graph neural network (GNN) formalism, which has become a dominant and fast-growing paradigm for deep learning with graph data. The book concludes with a synthesis of recent advancements in deep generative models for graphs—a nascent but quickly growing subset of graph representation learning.

Recent advancements in graph neural networks have expanded their capacities and expressive power. Furthermore, practical applications have begun to emerge in a variety of fields including recommendation systems, fake news detection, traffic prediction, molecular structure in chemistry, antibacterial discovery physics simulations, and more. As a result, a boom of research at the juncture of graph theory and deep learning has revolutionized many areas of research. However, while graph neural networks have drawn a lot of attention, they still face many challenges when it comes to applying them to other domains, from a conceptual understanding of methodologies to scalability and interpretability in a real system. Concepts and Techniques of Graph Neural Networks provides a stepwise discussion, an exhaustive literature review, detailed analysis and discussion, rigorous experimentation results, and application-oriented approaches that are demonstrated with respect to applications of graph neural networks. The book also develops the understanding of concepts and techniques of graph neural networks and establishes the familiarity of different real applications in various domains for graph neural networks. Covering key topics such as graph data, social networks, deep learning, and graph clustering, this premier reference source is ideal for industry professionals, researchers, scholars, academicians, practitioners, instructors, and students.

A comprehensive text on foundations and techniques of graph neural networks with applications in NLP, data mining, vision and healthcare.

The graph is a data structure that exists widely around us, including traditional fields like physics, biology, and cosmology, as well as emergent fields like social networks, software engineering, and financial trading platforms. The graph-structured data contains objects (nodes) information and reflects their relationships (edges). The learning tasks become more challenging when considering the nodes and edge information simultaneously. Traditional machine learning methods focus on nodes' attributes but ignore the structural information. We are now in an era of deep learning, which outperforms traditional machine learning methods in a wide range of tasks and has a significant impact on our daily lives. Driving by deep learning and neural networks, the deep learning-based graph neural networks (GNNs) become convincing and attractive tools to handle this non-Euclidean data structure. The dissertation thesis includes my research works throughout the Ph. D. research in two directions of graph data mining. The first direction is about the innovation and improvement of graph neural networks. A large number of GNNs have appeared, but as a general representation learning model, there are still some difficult topics worth delving into. I focus on three questions: Unsupervised/self-supervised Learning of GNNs, GNNs for heterogeneous graphs, and Training larger and deeper GNNs. Concerning unsupervised/self-supervised learning of GNNs, the dissertation introduces my research works contributing to it in Chapter 3 and Chapter 4. In Chapter 5, I introduce a mutual information maximization-based GNN for heterogeneous graph representation learning. Chapter 6 discusses my contributions to training larger and deeper GNNs through a subgraph-based learning framework. The other direction is the Application of GNNs in Real-world Topics. As an effective tool for processing graph data, GNNs being applied to solve real-world graph mining problems can further verify the effectiveness. Meanwhile, the application of GNNs requires a combination of domain knowledge and specific data modeling, which is also a challenge that needs to be addressed. In Chapter 7, I apply GNNs to the emerging and non-trivial topic of fake news detection. When dealing with the fake news detection topic, I innovate the GNNs model to handle the challenges of the fake news detection problem, which is critical for GNNs to exert the best effect. Experiments with real-world fake news data show that the novel GNN can outperform text-based models and other graph-based models, especially when using less labeled news data. In the last chapter, I provide concluding thoughts about this dissertation thesis.