GraphPPD: Posterior Predictive Modelling for Graph-Level Inference
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Abstract (arXiv)
Accurate modelling and quantification of predictive uncertainty is crucial in deep learning since it allows a model to make safer decisions when the data is ambiguous and facilitates the users' understanding of the model's confidence in its predictions. Along with the tremendously increasing research focus on graph neural networks (GNNs) in recent years, there have been numerous techniques which strive to capture the uncertainty in their predictions. However, most of these approaches are specifically designed for node or link-level tasks and cannot be directly applied to graph-level learning problems. In this paper, we propose a novel variational modelling framework for the posterior predictive distribution~(PPD) to obtain uncertainty-aware prediction in graph-level learning tasks. Based on a graph-level embedding derived from one of the existing GNNs, our framework can learn the PPD in a data-adaptive fashion. Experimental results on several benchmark datasets exhibit the effectiveness of our approach.
Key facts. No citing papers in the map yet (data through 14 Oct 2026). Builds on 48 of its 69 references that are in the map. First posted on arXiv 23 Aug 2025.
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References · 48
- 2017Attention Is All You Needcited by 60,361
- 2016Semi-Supervised Classification with Graph Convolutional Networkscited by 11,361
- 2015Dropout as a Bayesian Approximation: Representing Model Uncertainty in Deep Learningcited by 4,448
- 2018How Powerful are Graph Neural Networks?cited by 4,393
- 2016Simple and Scalable Predictive Uncertainty Estimation using Deep Ensemblescited by 3,926
- 2017Neural Message Passing for Quantum Chemistrycited by 3,487
- 2017Prototypical Networks for Few-shot Learningcited by 3,015
- 2020Open Graph Benchmark: Datasets for Machine Learning on Graphscited by 2,163
- 2016Convolutional Neural Networks on Graphs with Fast Localized Spectral Filteringcited by 2,089
- 2018Graph Convolutional Neural Networks for Web-Scale Recommender Systemscited by 1,138
- 2019Strategies for Pre-training Graph Neural Networkscited by 971
- 2018Weisfeiler and Leman Go Neural: Higher-order Graph Neural Networkscited by 881
36 more
- 2018Hierarchical Graph Representation Learning with Differentiable Poolingcited by 787
- 2015Convolutional Networks on Graphs for Learning Molecular Fingerprintscited by 754
- 2020TUDataset: A collection of benchmark datasets for learning with graphscited by 728
- 2022Recipe for a General, Powerful, Scalable Graph Transformercited by 713
- 2016Hyperband: A Novel Bandit-Based Approach to Hyperparameter Optimizationcited by 699
- 2020Benchmarking Graph Neural Networkscited by 680
- 2019Graph U-Netscited by 492
- 2021Rethinking Graph Transformers with Spectral Attentioncited by 473
- 2019Self-Attention Graph Poolingcited by 421
- 2018Tune: A Research Platform for Distributed Model Selection and Trainingcited by 395
- 2021Transformers Can Do Bayesian Inferencecited by 360
- 2021Graph Neural Networks with Learnable Structural and Positional Representationscited by 333
- 2021Do Transformers Really Perform Bad for Graph Representation?cited by 320
- 2018Neural Processescited by 311
- 2021What Are Bayesian Neural Network Posteriors Really Like?cited by 308
- 2019Attentive Neural Processescited by 283
- 2019ASAP: Adaptive Structure Aware Pooling for Learning Hierarchical Graph Representationscited by 156
- 2022Transformer Neural Processes: Uncertainty-Aware Meta Learning Via Sequence Modelingcited by 127
- 2021Accurate Learning of Graph Representations with Graph Multiset Poolingcited by 120
- 2019Fake News Detection on Social Media using Geometric Deep Learningcited by 118
- 2017Bayesian Compression for Deep Learningcited by 116
- 2018Meta-Learning Probabilistic Inference For Predictioncited by 110
- 2018Bayesian graph convolutional neural networks for semi-supervised classificationcited by 89
- 2017Geometric Matrix Completion with Recurrent Multi-Graph Neural Networkscited by 88
- 2020Bayesian Graph Neural Networks with Adaptive Connection Samplingcited by 81
- 2022Structural Entropy Guided Graph Hierarchical Poolingcited by 62
- 2015Bayesian Dark Knowledgecited by 45
- 2020Bootstrapping Neural Processescited by 40
- 2018Bayesian Semi-supervised Learning with Graph Gaussian Processescited by 28
- 2022Higher-order Clustering and Pooling for Graph Neural Networkscited by 26
- 2019A Flexible Generative Framework for Graph-based Semi-supervised Learningcited by 24
- 2021Measuring and Improving Model-Moderator Collaboration using Uncertainty Estimationcited by 18
- 2022Pretraining Graph Neural Networks for few-shot Analog Circuit Modeling and Designcited by 13
- 2020Non-Parametric Graph Learning for Bayesian Graph Neural Networkscited by 10
- 2019Graph Neural Processes: Towards Bayesian Graph Neural Networkscited by 6
- 2022The prediction of the quality of results in Logic Synthesis using Transformer and Graph Neural Networkscited by 1
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