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interpretable, and well understood models that are routinely employed even though, as is revealed through prior and posterior predictive checks, these can poorly characterise the spatial heterogeneity in the underlying process of interest.…

Machine Learning · Statistics 2024-04-08 Andrew Zammit-Mangion , Michael D. Kaminski , Ba-Hien Tran , Maurizio Filippone , Noel Cressie

Graph Neural Networks (GNNs) are a promising deep learning approach for circumventing many real-world problems on graph-structured data. However, these models usually have at least one of four fundamental limitations: over-smoothing,…

Machine Learning · Computer Science 2022-10-03 Xun Liu , Alex Hay-Man Ng , Fangyuan Lei , Yikuan Zhang , Zhengmin Li

This paper presents a new neural network (NN) paradigm for scalable and generalizable stability analysis of power systems. The paradigm consists of two parts: the neural stability descriptor and the sample-augmented iterative training…

Systems and Control · Electrical Eng. & Systems 2025-10-30 Tong Han , Yan Xu , Rui Zhang

Graph Neural Networks (GNN) provide a powerful framework that elegantly integrates Graph theory with Machine learning for modeling and analysis of networked data. We consider the problem of quantifying the uncertainty in predictions of GNN…

Machine Learning · Computer Science 2022-05-23 Sai Munikoti , Deepesh Agarwal , Laya Das , Balasubramaniam Natarajan

NeuroNet is a deep convolutional neural network mimicking multiple popular and state-of-the-art brain segmentation tools including FSL, SPM, and MALPEM. The network is trained on 5,000 T1-weighted brain MRI scans from the UK Biobank Imaging…

Computer Vision and Pattern Recognition · Computer Science 2018-06-13 Martin Rajchl , Nick Pawlowski , Daniel Rueckert , Paul M. Matthews , Ben Glocker

Graph neural networks (GNNs) are the predominant approach for graph-based machine learning. While neural networks have shown great performance at learning useful representations, they are often criticized for their limited high-level…

Machine Learning · Computer Science 2024-07-09 Markus Zopf , Francesco Alesiani

Neural networks are increasingly used as fast surrogate models across various domains, but unconstrained predictions can violate physical, operational, or safety requirements. We propose SnareNet, a feasibility-controlled architecture to…

Machine Learning · Computer Science 2026-05-12 Ya-Chi Chu , Alkiviades Boukas , Madeleine Udell

Recently, graph-based models designed for downstream tasks have significantly advanced research on graph neural networks (GNNs). GNN baselines based on neural message-passing mechanisms such as GCN and GAT perform worse as the network…

Machine Learning · Computer Science 2023-01-26 Jiayuan Chen , Xiang Zhang , Yinfei Xu , Tianli Zhao , Renjie Xie , Wei Xu

Balancing predictive power and interpretability has long been a challenging research area, particularly in powerful yet complex models like neural networks, where nonlinearity obstructs direct interpretation. This paper introduces a novel…

Machine Learning · Computer Science 2025-02-20 Antoine Ledent , Peng Liu

Graph Neural Networks (GNNs) have attracted increasing attention in recent years and have achieved excellent performance in semi-supervised node classification tasks. The success of most GNNs relies on one fundamental assumption, i.e., the…

Machine Learning · Computer Science 2024-12-03 Junchao Lin , Yuan Wan , Jingwen Xu , Xingchen Qi

Graph Neural Networks (GNNs) has been widely used in a variety of fields because of their great potential in representing graph-structured data. However, lacking of rigorous uncertainty estimations limits their application in high-stakes.…

Machine Learning · Computer Science 2025-01-07 Ting Wang , Zhixin Zhou , Rui Luo

Deep Neural Networks (DNNs) have made significant improvements to reach the desired accuracy to be employed in a wide variety of Machine Learning (ML) applications. Recently the Google Brain's team demonstrated the ability of Capsule…

Machine Learning · Computer Science 2021-01-26 Alberto Marchisio , Andrea Massa , Vojtech Mrazek , Beatrice Bussolino , Maurizio Martina , Muhammad Shafique

Deep neural networks (NNs) are powerful black box predictors that have recently achieved impressive performance on a wide spectrum of tasks. Quantifying predictive uncertainty in NNs is a challenging and yet unsolved problem. Bayesian NNs,…

Machine Learning · Statistics 2017-11-07 Balaji Lakshminarayanan , Alexander Pritzel , Charles Blundell

Propositional satisfiability (SAT) is an NP-complete problem that impacts many research fields, such as planning, verification, and security. Mainstream modern SAT solvers are based on the Conflict-Driven Clause Learning (CDCL) algorithm.…

Artificial Intelligence · Computer Science 2024-05-10 Wenxi Wang , Yang Hu , Mohit Tiwari , Sarfraz Khurshid , Kenneth McMillan , Risto Miikkulainen

Ensuring that the outputs of neural networks satisfy specific constraints is crucial for applying neural networks to real-life decision-making problems. In this paper, we consider making a batch of neural network outputs satisfy bounded and…

Artificial Intelligence · Computer Science 2024-11-12 Hongtai Zeng , Chao Yang , Yanzhen Zhou , Cheng Yang , Qinglai Guo

In this paper, we introduce the Action Schema Network (ASNet): a neural network architecture for learning generalised policies for probabilistic planning problems. By mimicking the relational structure of planning problems, ASNets are able…

Artificial Intelligence · Computer Science 2017-12-25 Sam Toyer , Felipe Trevizan , Sylvie Thiébaux , Lexing Xie

Sparse neural networks are important for achieving better generalization and enhancing computation efficiency. This paper proposes a novel learning approach to obtain sparse fully connected layers in neural networks (NNs) automatically. We…

Machine Learning · Computer Science 2021-04-28 Mengqiao Han , Xiabi Liu , Zhaoyang Hai , Zhengwen Li

Many combinatorial optimization problems can be phrased in the language of constraint satisfaction problems. We introduce a graph neural network architecture for solving such optimization problems. The architecture is generic; it works for…

Artificial Intelligence · Computer Science 2020-02-12 Jan Toenshoff , Martin Ritzert , Hinrikus Wolf , Martin Grohe

Modern neural networks obtain information about the problem and calculate the output solely from the input values. We argue that it is not always optimal, and the network's performance can be significantly improved by augmenting it with a…

Machine Learning · Computer Science 2022-10-11 Emils Ozolins , Karlis Freivalds , Andis Draguns , Eliza Gaile , Ronalds Zakovskis , Sergejs Kozlovics

Randomized algorithms are used in many state-of-the-art solvers for constraint satisfaction problems (CSP) and Boolean satisfiability (SAT) problems. For many of these problems, there is no single solver which will dominate others. Having…

Machine Learning · Computer Science 2021-06-25 Jake Tuero , Michael Buro