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Convolutional Neural Networks on Graphs with Chebyshev Approximation, Revisited

Neural Information Processing Systems

Designing spectral convolutional networks is a challenging problem in graph learning. ChebNet, one of the early attempts, approximates the spectral graph convolutions using Chebyshev polynomials.




Enhancing Spectral Graph Neural Networks with LLM-Predicted Homophily

Lu, Kangkang, Yu, Yanhua, Huang, Zhiyong, Chua, Tat-Seng

arXiv.org Artificial Intelligence

Spectral Graph Neural Networks (SGNNs) have achieved remarkable performance in tasks such as node classification due to their ability to learn flexible filters. Typically, these filters are learned under the supervision of downstream tasks, enabling SGNNs to adapt to diverse structural patterns. However, in scenarios with limited labeled data, SGNNs often struggle to capture the optimal filter shapes, resulting in degraded performance, especially on graphs with heterophily. Meanwhile, the rapid progress of Large Language Models (LLMs) has opened new possibilities for enhancing graph learning without modifying graph structure or requiring task-specific training. In this work, we propose a novel framework that leverages LLMs to estimate the homophily level of a graph and uses this global structural prior to guide the construction of spectral filters. Specifically, we design a lightweight and plug-and-play pipeline where a small set of labeled node pairs is formatted as natural language prompts for the LLM, which then predicts the graph's homophily ratio. This estimated value informs the spectral filter basis, enabling SGNNs to adapt more effectively to both homophilic and heterophilic structures. Extensive experiments on multiple benchmark datasets demonstrate that our LLM-assisted spectral framework consistently improves performance over strong SGNN baselines.


Convolutional Neural Networks on Graphs with Chebyshev Approximation, Revisited

Neural Information Processing Systems

Designing spectral convolutional networks is a challenging problem in graph learning. ChebNet, one of the early attempts, approximates the spectral graph convolutions using Chebyshev polynomials. GPR-GNN and BernNet demonstrate that the Monomial and Bernstein bases also outperform the Chebyshev basis in terms of learning the spectral graph convolutions. Such conclusions are counter-intuitive in the field of approximation theory, where it is established that the Chebyshev polynomial achieves the optimum convergent rate for approximating a function. In this paper, we revisit the problem of approximating the spectral graph convolutions with Chebyshev polynomials.


A Quasi-Wasserstein Loss for Learning Graph Neural Networks

Cheng, Minjie, Xu, Hongteng

arXiv.org Artificial Intelligence

When learning graph neural networks (GNNs) in node-level prediction tasks, most existing loss functions are applied for each node independently, even if node embeddings and their labels are non-i.i.d. because of their graph structures. To eliminate such inconsistency, in this study we propose a novel Quasi-Wasserstein (QW) loss with the help of the optimal transport defined on graphs, leading to new learning and prediction paradigms of GNNs. In particular, we design a "Quasi-Wasserstein" distance between the observed multi-dimensional node labels and their estimations, optimizing the label transport defined on graph edges. The estimations are parameterized by a GNN in which the optimal label transport may determine the graph edge weights optionally. By reformulating the strict constraint of the label transport to a Bregman divergence-based regularizer, we obtain the proposed Quasi-Wasserstein loss associated with two efficient solvers learning the GNN together with optimal label transport. When predicting node labels, our model combines the output of the GNN with the residual component provided by the optimal label transport, leading to a new transductive prediction paradigm. Experiments show that the proposed QW loss applies to various GNNs and helps to improve their performance in node-level classification and regression tasks.


Learning Graph Filters for Spectral GNNs via Newton Interpolation

Xu, Junjie, Dai, Enyan, Luo, Dongsheng, Zhang, Xiang, Wang, Suhang

arXiv.org Artificial Intelligence

Spectral Graph Neural Networks (GNNs) are gaining attention because they can surpass the limitations of message-passing GNNs by learning spectral filters that capture essential frequency information in graph data through task supervision. However, previous research suggests that the choice of filter frequency is tied to the graph's homophily level, a connection that hasn't been thoroughly explored in existing spectral GNNs. To address this gap, the study conducts both theoretical and empirical analyses, revealing that low-frequency filters have a positive correlation with homophily, while high-frequency filters have a negative correlation. This leads to the introduction of a shape-aware regularization technique applied to a Newton Interpolation-based spectral filter, enabling the customization of polynomial spectral filters that align with desired homophily levels. Extensive experiments demonstrate that NewtonNet successfully achieves the desired filter shapes and exhibits superior performance on both homophilous and heterophilous datasets.