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Permutation Equivariant Graph Framelets for Heterophilous Graph Learning

arXiv.org Artificial Intelligence

The nature of heterophilous graphs is significantly different from that of homophilous graphs, which causes difficulties in early graph neural network models and suggests aggregations beyond the 1-hop neighborhood. In this paper, we develop a new way to implement multi-scale extraction via constructing Haar-type graph framelets with desired properties of permutation equivariance, efficiency, and sparsity, for deep learning tasks on graphs. We further design a graph framelet neural network model PEGFAN (Permutation Equivariant Graph Framelet Augmented Network) based on our constructed graph framelets. The experiments are conducted on a synthetic dataset and 9 benchmark datasets to compare performance with other state-of-the-art models. The result shows that our model can achieve the best performance on certain datasets of heterophilous graphs (including the majority of heterophilous datasets with relatively larger sizes and denser connections) and competitive performance on the remaining.


Revisiting Generalized p-Laplacian Regularized Framelet GCNs: Convergence, Energy Dynamic and Training with Non-Linear Diffusion

arXiv.org Artificial Intelligence

This paper presents a comprehensive theoretical analysis of the graph p-Laplacian regularized framelet network (pL-UFG) to establish a solid understanding of its properties. We conduct a convergence analysis on pL-UFG, addressing the gap in the understanding of its asymptotic behaviors. Further by investigating the generalized Dirichlet energy of pL-UFG, we demonstrate that the Dirichlet energy remains non-zero throughout convergence, ensuring the avoidance of over-smoothing issues. Additionally, we elucidate the energy dynamic perspective, highlighting the synergistic relationship between the implicit layer in pL-UFG and graph framelets. This synergy enhances the model's adaptability to both homophilic and heterophilic data. Notably, we reveal that pL-UFG can be interpreted as a generalized non-linear diffusion process, thereby bridging the gap between pL-UFG and differential equations on the graph. Importantly, these multifaceted analyses lead to unified conclusions that offer novel insights for understanding and implementing pL-UFG, as well as other graph neural network (GNN) models. Finally, based on our dynamic analysis, we propose two novel pL-UFG models with manually controlled energy dynamics. We demonstrate empirically and theoretically that our proposed models not only inherit the advantages of pL-UFG but also significantly reduce computational costs for training on large-scale graph datasets.


A signal processing interpretation of noise-reduction convolutional neural networks

arXiv.org Artificial Intelligence

Encoding-decoding CNNs play a central role in data-driven noise reduction and can be found within numerous deep-learning algorithms. However, the development of these CNN architectures is often done in ad-hoc fashion and theoretical underpinnings for important design choices is generally lacking. Up to this moment there are different existing relevant works that strive to explain the internal operation of these CNNs. Still, these ideas are either scattered and/or may require significant expertise to be accessible for a bigger audience. In order to open up this exciting field, this article builds intuition on the theory of deep convolutional framelets and explains diverse ED CNN architectures in a unified theoretical framework. By connecting basic principles from signal processing to the field of deep learning, this self-contained material offers significant guidance for designing robust and efficient novel CNN architectures.


How Curvature Enhance the Adaptation Power of Framelet GCNs

arXiv.org Artificial Intelligence

Graph neural network (GNN) has been demonstrated powerful in modeling graph-structured data. However, despite many successful cases of applying GNNs to various graph classification and prediction tasks, whether the graph geometrical information has been fully exploited to enhance the learning performance of GNNs is not yet well understood. This paper introduces a new approach to enhance GNN by discrete graph Ricci curvature. Specifically, the graph Ricci curvature defined on the edges of a graph measures how difficult the information transits on one edge from one node to another based on their neighborhoods. Motivated by the geometric analogy of Ricci curvature in the graph setting, we prove that by inserting the curvature information with different carefully designed transformation function $\zeta$, several known computational issues in GNN such as over-smoothing can be alleviated in our proposed model. Furthermore, we verified that edges with very positive Ricci curvature (i.e., $\kappa_{i,j} \approx 1$) are preferred to be dropped to enhance model's adaption to heterophily graph and one curvature based graph edge drop algorithm is proposed. Comprehensive experiments show that our curvature-based GNN model outperforms the state-of-the-art baselines in both homophily and heterophily graph datasets, indicating the effectiveness of involving graph geometric information in GNNs.


Generalized Laplacian Regularized Framelet Graph Neural Networks

arXiv.org Artificial Intelligence

Graph neural networks (GNNs) have demonstrated remarkable ability for graph learning tasks (Bronstein et al, 2017; Wu et al, 2020; Zhang et al, 2022; Zhou et al, 2020). The input to GNNs is the so-called graph data which records useful features and structural information among data. Such data are widely seen in many fields, such as biomedical science (Ahmedt-Aristizabal et al, 2021), social networks (Fan et al, 2019), and recommend systems (Wu et al, 2022). GNN models can be broadly categorized into spectral and spatial methods. The spatial methods such as MPNN (Gilmer et al, 2017), GAT (Veliฤkoviฤ‡ et al, 2018) and GIN (Xu et al, 2018a) utilize the message passing mechanism to propagate node feature information based on their neighbours (Scarselli et al, 2009). On the other hand, the spectral methods including ChebyNet (Defferrard et al, 2016), GCN (Kipf and Welling, 2017) and BernNet (He et al, 2021) are derived from the classic convolutional networks, treating the input graph data as signals (i.e., a function with the domain of graph nodes) (Ortega et al, 2018), and filtering signals in the Fourier domain (Bruna et al, 2014; Defferrard et al, 2016).


Frameless Graph Knowledge Distillation

arXiv.org Artificial Intelligence

Knowledge distillation (KD) has shown great potential for transferring knowledge from a complex teacher model to a simple student model in which the heavy learning task can be accomplished efficiently and without losing too much prediction accuracy. Recently, many attempts have been made by applying the KD mechanism to the graph representation learning models such as graph neural networks (GNNs) to accelerate the model's inference speed via student models. However, many existing KD-based GNNs utilize MLP as a universal approximator in the student model to imitate the teacher model's process without considering the graph knowledge from the teacher model. In this work, we provide a KD-based framework on multi-scaled GNNs, known as graph framelet, and prove that by adequately utilizing the graph knowledge in a multi-scaled manner provided by graph framelet decomposition, the student model is capable of adapting both homophilic and heterophilic graphs and has the potential of alleviating the over-squashing issue with a simple yet effectively graph surgery. Furthermore, we show how the graph knowledge supplied by the teacher is learned and digested by the student model via both algebra and geometry. Comprehensive experiments show that our proposed model can generate learning accuracy identical to or even surpass the teacher model while maintaining the high speed of inference.


Quasi-Framelets: Another Improvement to GraphNeural Networks

arXiv.org Artificial Intelligence

This paper aims to provide a novel design of a multiscale framelets convolution for spectral graph neural networks. In the spectral paradigm, spectral GNNs improve graph learning task performance via proposing various spectral filters in spectral domain to capture both global and local graph structure information. Although the existing spectral approaches show superior performance in some graphs, they suffer from lack of flexibility and being fragile when graph information are incomplete or perturbated. Our new framelets convolution incorporates the filtering func-tions directly designed in the spectral domain to overcome these limitations. The proposed convolution shows a great flexibility in cutting-off spectral information and effectively mitigate the negative effect of noisy graph signals. Besides, to exploit the heterogeneity in real-world graph data, the heterogeneous graph neural network with our new framelet convolution provides a solution for embedding the intrinsic topological information of meta-path with a multi-level graph analysis.Extensive experiments have been conducted on real-world heterogeneous graphs and homogeneous graphs under settings with noisy node features and superior performance results are achieved.


How Framelets Enhance Graph Neural Networks

arXiv.org Artificial Intelligence

This paper presents a new approach for assembling graph neural networks based on framelet transforms. The latter provides a multi-scale representation for graph-structured data. With the framelet system, we can decompose the graph feature into low-pass and high-pass frequencies as extracted features for network training, which then defines a framelet-based graph convolution. The framelet decomposition naturally induces a graph pooling strategy by aggregating the graph feature into low-pass and high-pass spectra, which considers both the feature values and geometry of the graph data and conserves the total information. The graph neural networks with the proposed framelet convolution and pooling achieve state-of-the-art performance in many types of node and graph prediction tasks. Moreover, we propose shrinkage as a new activation for the framelet convolution, which thresholds the high-frequency information at different scales. Compared to ReLU, shrinkage in framelet convolution improves the graph neural network model in terms of denoising and signal compression: noises in both node and structure can be significantly reduced by accurately cutting off the high-pass coefficients from framelet decomposition, and the signal can be compressed to less than half its original size with the prediction performance well preserved.


Framelet Pooling Aided Deep Learning Network : The Method to Process High Dimensional Medical Data

arXiv.org Machine Learning

Machine learning-based analysis of medical images often faces several hurdles, such as the lack of training data, the curse of dimensionality problem, and the generalization issues. One of the main difficulties is that there exists computational cost problem in dealing with input data of large size matrices which represent medical images. The purpose of this paper is to introduce a framelet-pooling aided deep learning method for mitigating computational bundle, caused by large dimensionality. By transforming high dimensional data into low dimensional components by filter banks with preserving detailed information, the proposed method aims to reduce the complexity of the neural network and computational costs significantly during the learning process. Various experiments show that our method is comparable to the standard unreduced learning method, while reducing computational burdens by decomposing large-sized learning tasks into several small-scale learning tasks.