Unveiling Mode Connectivity in Graph Neural Networks

Fuente: arXiv
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Autori principali: Li, Bingheng, Chen, Zhikai, Han, Haoyu, Zeng, Shenglai, Liu, Jingzhe, Tang, Jiliang
Natura: Preprint
Pubblicazione: 2025
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author Li, Bingheng
Chen, Zhikai
Han, Haoyu
Zeng, Shenglai
Liu, Jingzhe
Tang, Jiliang
author_facet Li, Bingheng
Chen, Zhikai
Han, Haoyu
Zeng, Shenglai
Liu, Jingzhe
Tang, Jiliang
contents A fundamental challenge in understanding graph neural networks (GNNs) lies in characterizing their optimization dynamics and loss landscape geometry, critical for improving interpretability and robustness. While mode connectivity, a lens for analyzing geometric properties of loss landscapes has proven insightful for other deep learning architectures, its implications for GNNs remain unexplored. This work presents the first investigation of mode connectivity in GNNs. We uncover that GNNs exhibit distinct non-linear mode connectivity, diverging from patterns observed in fully-connected networks or CNNs. Crucially, we demonstrate that graph structure, rather than model architecture, dominates this behavior, with graph properties like homophily correlating with mode connectivity patterns. We further establish a link between mode connectivity and generalization, proposing a generalization bound based on loss barriers and revealing its utility as a diagnostic tool. Our findings further bridge theoretical insights with practical implications: they rationalize domain alignment strategies in graph learning and provide a foundation for refining GNN training paradigms.
format Preprint
id arxiv_https___arxiv_org_abs_2502_12608
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Unveiling Mode Connectivity in Graph Neural Networks
Li, Bingheng
Chen, Zhikai
Han, Haoyu
Zeng, Shenglai
Liu, Jingzhe
Tang, Jiliang
Machine Learning
Artificial Intelligence
A fundamental challenge in understanding graph neural networks (GNNs) lies in characterizing their optimization dynamics and loss landscape geometry, critical for improving interpretability and robustness. While mode connectivity, a lens for analyzing geometric properties of loss landscapes has proven insightful for other deep learning architectures, its implications for GNNs remain unexplored. This work presents the first investigation of mode connectivity in GNNs. We uncover that GNNs exhibit distinct non-linear mode connectivity, diverging from patterns observed in fully-connected networks or CNNs. Crucially, we demonstrate that graph structure, rather than model architecture, dominates this behavior, with graph properties like homophily correlating with mode connectivity patterns. We further establish a link between mode connectivity and generalization, proposing a generalization bound based on loss barriers and revealing its utility as a diagnostic tool. Our findings further bridge theoretical insights with practical implications: they rationalize domain alignment strategies in graph learning and provide a foundation for refining GNN training paradigms.
title Unveiling Mode Connectivity in Graph Neural Networks
topic Machine Learning
Artificial Intelligence
url https://arxiv.org/abs/2502.12608