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Given the importance of getting calibrated predictions and reliable uncertainty estimations, various post-hoc calibration methods have been developed for neural networks on standard multi-class classification tasks. However, these methods…

Machine Learning · Computer Science 2022-10-13 Hans Hao-Hsun Hsu , Yuesong Shen , Christian Tomani , Daniel Cremers

Graph Neural Networks (GNNs) have demonstrated strong predictive performance on relational data; however, their confidence estimates often misalign with actual predictive correctness, posing significant limitations for deployment in…

Machine Learning · Computer Science 2025-07-09 Xiaoyang Li , Linwei Tao , Haohui Lu , Minjing Dong , Junbin Gao , Chang Xu

Graphs can model real-world, complex systems by representing entities and their interactions in terms of nodes and edges. To better exploit the graph structure, graph neural networks have been developed, which learn entity and edge…

Machine Learning · Computer Science 2022-06-06 Tong Liu , Yushan Liu , Marcel Hildebrandt , Mitchell Joblin , Hang Li , Volker Tresp

Ensemble forecasts from numerical weather prediction models show systematic errors that require correction via post-processing. While there has been substantial progress in flexible neural network-based post-processing methods over the past…

Machine Learning · Computer Science 2024-07-17 Moritz Feik , Sebastian Lerch , Jan Stühmer

The prediction reliability of neural networks is important in many applications. Specifically, in safety-critical domains, such as cancer prediction or autonomous driving, a reliable confidence of model's prediction is critical for the…

Computer Vision and Pattern Recognition · Computer Science 2019-09-24 Byeongmoon Ji , Hyemin Jung , Jihyeun Yoon , Kyungyul Kim , Younghak Shin

Despite Graph Neural Networks (GNNs) have achieved remarkable accuracy, whether the results are trustworthy is still unexplored. Previous studies suggest that many modern neural networks are over-confident on the predictions, however,…

Machine Learning · Computer Science 2022-01-05 Xiao Wang , Hongrui Liu , Chuan Shi , Cheng Yang

Accurate uncertainty quantification in graph neural networks (GNNs) is essential, especially in high-stakes domains where GNNs are frequently employed. Conformal prediction (CP) offers a promising framework for quantifying uncertainty by…

Machine Learning · Computer Science 2023-12-06 Seohyeon Cha , Honggu Kang , Joonhyuk Kang

Accurate regional ocean forecasting requires models that are both computationally efficient and capable of representing predictive uncertainty. This work investigates ensemble learning strategies for sea surface temperature (SST)…

Machine Learning · Computer Science 2026-03-09 Alejandro J. González-Santana , Giovanny A. Cuervo-Londoño , Javier Sánchez

It is now well known that neural networks can be wrong with high confidence in their predictions, leading to poor calibration. The most common post-hoc approach to compensate for this is to perform temperature scaling, which adjusts the…

Computer Vision and Pattern Recognition · Computer Science 2022-07-25 Tom Joy , Francesco Pinto , Ser-Nam Lim , Philip H. S. Torr , Puneet K. Dokania

Graph Neural Networks (GNNs) have demonstrated remarkable effectiveness on graph-based tasks. However, their predictive confidence is often miscalibrated, typically exhibiting under-confidence, which harms the reliability of their…

Machine Learning · Computer Science 2025-09-30 Jincheng Huang , Jie Xu , Xiaoshuang Shi , Ping Hu , Lei Feng , Xiaofeng Zhu

Graph Neural Networks (GNNs) have proven to be successful in many classification tasks, outperforming previous state-of-the-art methods in terms of accuracy. However, accuracy alone is not enough for high-stakes decision making. Decision…

Machine Learning · Computer Science 2019-06-04 Leonardo Teixeira , Brian Jalaian , Bruno Ribeiro

Despite their incredible performance, it is well reported that deep neural networks tend to be overoptimistic about their prediction confidence. Finding effective and efficient calibration methods for neural networks is therefore an…

Machine Learning · Computer Science 2023-09-07 Lucas Clarté , Bruno Loureiro , Florent Krzakala , Lenka Zdeborová

Recent advancements in graph neural networks (GNNs) have highlighted the critical need of calibrating model predictions, with neighborhood prediction similarity recognized as a pivotal component. Existing studies suggest that nodes with…

Machine Learning · Computer Science 2025-02-25 Hyunjin Seo , Kyusung Seo , Joonhyung Park , Eunho Yang

We address the problem of uncertainty calibration and introduce a novel calibration method, Parametrized Temperature Scaling (PTS). Standard deep neural networks typically yield uncalibrated predictions, which can be transformed into…

Machine Learning · Computer Science 2022-09-20 Christian Tomani , Daniel Cremers , Florian Buettner

Confidence calibration -- the problem of predicting probability estimates representative of the true correctness likelihood -- is important for classification models in many applications. We discover that modern neural networks, unlike…

Machine Learning · Computer Science 2017-08-04 Chuan Guo , Geoff Pleiss , Yu Sun , Kilian Q. Weinberger

Graph matching is a commonly used technique in computer vision and pattern recognition. Recent data-driven approaches have improved the graph matching accuracy remarkably, whereas some traditional algorithm-based methods are more robust to…

Computer Vision and Pattern Recognition · Computer Science 2024-03-12 Haoru Tan , Chuang Wang , Sitong Wu , Xu-Yao Zhang , Fei Yin , Cheng-Lin Liu

Scalability of Graph Neural Networks (GNNs) remains a significant challenge. To tackle this, methods like coarsening, condensation, and computation trees are used to train on a smaller graph, resulting in faster computation. Nonetheless,…

Machine Learning · Computer Science 2026-04-13 Shubhajit Roy , Hrriday Ruparel , Kishan Ved , Anirban Dasgupta

Recently, Deep Neural Networks (DNNs) have been achieving impressive results on wide range of tasks. However, they suffer from being well-calibrated. In decision-making applications, such as autonomous driving or medical diagnosing, the…

Machine Learning · Computer Science 2019-05-10 Azadeh Sadat Mozafari , Hugo Siqueira Gomes , Wilson Leão , Steeven Janny , Christian Gagné

Developing scalable solutions for training Graph Neural Networks (GNNs) for link prediction tasks is challenging due to the high data dependencies which entail high computational cost and huge memory footprint. We propose a new method for…

Machine Learning · Computer Science 2022-01-11 Nasrullah Sheikh , Xiao Qin , Berthold Reinwald , Chuan Lei

Consistency training is a popular method to improve deep learning models in computer vision and natural language processing. Graph neural networks (GNNs) have achieved remarkable performance in a variety of network science learning tasks,…

Machine Learning · Computer Science 2021-10-14 Cole Hawkins , Vassilis N. Ioannidis , Soji Adeshina , George Karypis
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