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Hypergraph Neural Stochastic Diffusion: An SDE Framework for Uncertainty Estimation

arXiv 2607.07330 ↗First posted 8 Jul 2026cs.LG cs.AIcited by 0

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Abstract (arXiv)

Hypergraph neural networks have shown powerful capability in modeling higher-order relations, yet their predictive uncertainty remains underexplored. Unlike pairwise graphs, uncertainty in hypergraphs arises not only from noisy attributes and ambiguous labels, but also from variations in node-hyperedge incidence structures and complex higher-order dependencies. Existing approaches mainly estimate uncertainty from final predictions or rely on computationally expensive ensembles and Bayesian inference, limiting their ability to capture uncertainty evolution during representation learning. In this paper, we propose Hypergraph Neural Stochastic Diffusion(HyperNSD), a stochastic differential equation framework for uncertainty estimation on hypergraphs. HyperNSD models hypergraph representations as stochastic processes evolving over node-hyperedge incidence structures. A learnable drift function captures deterministic higher-order diffusion dynamics, while a learnable stochastic forcing function characterizes structural ambiguity and representation noise. Predictive uncertainty is directly quantified through the variability of stochastic representation trajectories, providing an intrinsic uncertainty measure beyond post-hoc confidence scores. We formulate HyperNSD with neural drift and diffusion networks, enabling joint learning of prediction and uncertainty propagation. Theoretical analyses establish well posedness, perturbation stability,permutation equivariance, and numerical convergence of the proposed stochastic dynamics. Experiments on multiple hypergraph benchmarks demonstrate that HyperNSD achieves reliable uncertainty estimation for out-of-distribution and misclassification detection while preserving competitive prediction accuracy. These results provide a principled stochastic-dynamical framework for trustworthy higher-order representation learning.

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30 of 46 references.

References · 30

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18 more
  1. 2020HNHN: Hypergraph Networks with Hyperedge Neuronscited by 104
  2. 2020Uncertainty Aware Semi-Supervised Learning on Graph Datacited by 95
  3. 2021Graph Posterior Network: Bayesian Predictive Uncertainty for Node Classificationcited by 79
  4. 2020SDE-Net: Equipping Deep Neural Networks with Uncertainty Estimatescited by 75
  5. 2023Energy-based Out-of-Distribution Detection for Graph Neural Networkscited by 67
  6. 2022Equivariant Hypergraph Diffusion Neural Operatorscited by 45
  7. 2019Uncertainty on Asynchronous Time Event Predictioncited by 27
  8. 2024A Survey on Hypergraph Neural Networks: An In-Depth and Step-By-Step Guidecited by 22
  9. 2023From Hypergraph Energy Functions to Hypergraph Neural Networkscited by 17
  10. 2025GOLD: Graph Out-of-Distribution Detection via Implicit Adversarial Latent Generationcited by 15
  11. 2022Equivariant Hypergraph Neural Networkscited by 14
  12. 2024Energy-based Epistemic Uncertainty for Graph Neural Networkscited by 14
  13. 2023Hypergraph Neural Networks through the Lens of Message Passing: A Common Perspective to Homophily and Architecture Designcited by 13
  14. 2022A Hypergraph Neural Network Framework for Learning Hyperedge-Dependent Node Embeddingscited by 9
  15. 2024Uncertainty Modeling in Graph Neural Networks via Stochastic Differential Equationscited by 8
  16. 2025Uncertainty Estimation on Graphs with Structure Informed Stochastic Partial Differential Equationscited by 2
  17. 2026Tackling Over-smoothing on Hypergraphs: A Ricci Flow-guided Neural Diffusion Approachcited by 2
  18. 2026Hypergraph Neural Diffusion: A PDE-Inspired Framework for Hypergraph Message Passingcited by 2

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