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A rising trend in theoretical deep learning is to understand why deep learning works through Neural Tangent Kernel (NTK) [jgh18], a kernel method that is equivalent to using gradient descent to train a multi-layer infinitely-wide neural…

机器学习 · 计算机科学 2023-09-15 Lianke Qin , Zhao Song , Baocheng Sun

Graph neural networks (GNNs) achieve remarkable performance in graph machine learning tasks but can be hard to train on large-graph data, where their learning dynamics are not well understood. We investigate the training dynamics of…

机器学习 · 计算机科学 2023-06-02 Sanjukta Krishnagopal , Luana Ruiz

While graph kernels (GKs) are easy to train and enjoy provable theoretical guarantees, their practical performances are limited by their expressive power, as the kernel function often depends on hand-crafted combinatorial features of…

机器学习 · 计算机科学 2019-11-05 Simon S. Du , Kangcheng Hou , Barnabás Póczos , Ruslan Salakhutdinov , Ruosong Wang , Keyulu Xu

Graph Convolutional Networks (GCNs) have emerged as powerful tools for learning on network structured data. Although empirically successful, GCNs exhibit certain behaviour that has no rigorous explanation -- for instance, the performance of…

机器学习 · 计算机科学 2023-11-07 Mahalakshmi Sabanayagam , Pascal Esser , Debarghya Ghoshdastidar

The rapid development of Internet technology has given rise to a vast amount of graph-structured data. Graph Neural Networks (GNNs), as an effective method for various graph mining tasks, incurs substantial computational resource costs when…

机器学习 · 计算机科学 2024-03-04 Lin Wang , Wenqi Fan , Jiatong Li , Yao Ma , Qing Li

While kernel methods and Graph Neural Networks offer complementary strengths, integrating the two has posed challenges in efficiency and scalability. The Graph Neural Tangent Kernel provides a theoretical bridge by interpreting GNNs through…

机器学习 · 计算机科学 2025-07-17 Lin Wang , Shijie Wang , Sirui Huang , Qing Li

The Neural Tangent Kernel (NTK) characterizes the behavior of infinitely-wide neural networks trained under least squares loss by gradient descent. Recent works also report that NTK regression can outperform finitely-wide neural networks…

机器学习 · 计算机科学 2021-12-09 Amir Zandieh , Insu Han , Haim Avron , Neta Shoham , Chaewon Kim , Jinwoo Shin

Graph Neural Networks (GNNs) are widely applied to graph learning problems such as node classification. When scaling up the underlying graphs of GNNs to a larger size, we are forced to either train on the complete graph and keep the full…

机器学习 · 计算机科学 2024-06-25 Mucong Ding , Tahseen Rabbani , Bang An , Evan Z Wang , Furong Huang

Neural tangent kernels (NTKs) provide a theoretical regime to analyze the learning and generalization behavior of over-parametrized neural networks. For a supervised learning task, the association between the eigenvectors of the NTK kernel…

机器学习 · 计算机科学 2023-10-18 Shervin Khalafi , Saurabh Sihag , Alejandro Ribeiro

The Neural Tangent Kernel (NTK) characterizes the behavior of infinitely wide neural nets trained under least squares loss by gradient descent. However, despite its importance, the super-quadratic runtime of kernel methods limits the use of…

机器学习 · 计算机科学 2021-07-28 Amir Zandieh

Graph neural networks (GNNs) have achieved superior performance on node classification tasks in the last few years. Commonly, this is framed in a transductive semi-supervised learning setup wherein the entire graph, including the target…

机器学习 · 计算机科学 2021-10-11 Artun Bayer , Arindam Chowdhury , Santiago Segarra

Many machine learning techniques have been proposed in the last few years to process data represented in graph-structured form. Graphs can be used to model several scenarios, from molecules and materials to RNA secondary structures. Several…

机器学习 · 计算机科学 2018-11-19 Nicolò Navarin , Dinh V. Tran , Alessandro Sperduti

Graph convolutional networks (GCNs) and their variants have achieved great success in dealing with graph-structured data. Nevertheless, it is well known that deep GCNs suffer from the over-smoothing problem, where node representations tend…

机器学习 · 计算机科学 2022-04-22 Wei Huang , Yayong Li , Weitao Du , Jie Yin , Richard Yi Da Xu , Ling Chen , Miao Zhang

The advent of Graph Neural Networks (GNNs) has revolutionized the field of machine learning, offering a novel paradigm for learning on graph-structured data. Unlike traditional neural networks, GNNs are capable of capturing complex…

硬件体系结构 · 计算机科学 2024-06-26 Kaustubh Shivdikar

Graph neural networks (GNNs) have demonstrated great success in representation learning for graph-structured data. The layer-wise graph convolution in GNNs is shown to be powerful at capturing graph topology. During this process, GNNs are…

机器学习 · 计算机科学 2021-12-10 Mingxuan Ju , Shifu Hou , Yujie Fan , Jianan Zhao , Liang Zhao , Yanfang Ye

Graph Neural Networks (GNNs) are powerful deep learning models to generate node embeddings on graphs. When applying deep GNNs on large graphs, it is still challenging to perform training in an efficient and scalable way. We propose a novel…

机器学习 · 计算机科学 2020-10-08 Hanqing Zeng , Hongkuan Zhou , Ajitesh Srivastava , Rajgopal Kannan , Viktor Prasanna

Infinite width limit has shed light on generalization and optimization aspects of deep learning by establishing connections between neural networks and kernel methods. Despite their importance, the utility of these kernel methods was…

机器学习 · 计算机科学 2022-09-12 Insu Han , Amir Zandieh , Jaehoon Lee , Roman Novak , Lechao Xiao , Amin Karbasi

The study of deep neural networks (DNNs) in the infinite-width limit, via the so-called neural tangent kernel (NTK) approach, has provided new insights into the dynamics of learning, generalization, and the impact of initialization. One key…

机器学习 · 计算机科学 2021-06-16 Sina Alemohammad , Zichao Wang , Randall Balestriero , Richard Baraniuk

Graph neural networks (GNNs) are widely applied in graph data modeling. However, existing GNNs are often trained in a task-driven manner that fails to fully capture the intrinsic nature of the graph structure, resulting in sub-optimal node…

机器学习 · 计算机科学 2024-07-17 Zhenhua Huang , Kunhao Li , Shaojie Wang , Zhaohong Jia , Wentao Zhu , Sharad Mehrotra

Graph Neural Networks (GNNs) have become powerful tools for learning from graph-structured data, finding applications across diverse domains. However, as graph sizes and connectivity increase, standard GNN training methods face significant…

机器学习 · 计算机科学 2025-12-01 Eshed Gal , Moshe Eliasof , Carola-Bibiane Schönlieb , Ivan I. Kyrchei , Eldad Haber , Eran Treister
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