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Bayesian Neural Networks (BNNs) place priors over the parameters in a neural network. Inference in BNNs, however, is difficult; all inference methods for BNNs are approximate. In this work, we empirically compare the quality of predictive…

Machine Learning · Computer Science 2019-06-25 Jiayu Yao , Weiwei Pan , Soumya Ghosh , Finale Doshi-Velez

To improve trust and transparency, it is crucial to be able to interpret the decisions of Deep Neural classifiers (DNNs). Instance-level examinations, such as attribution techniques, are commonly employed to interpret the model decisions.…

Machine Learning · Computer Science 2025-03-13 Youngju Joung , Sehyun Lee , Jaesik Choi

Parameter inference and uncertainty quantification are important steps when relating mathematical models to real-world observations, and when estimating uncertainty in model predictions. However, methods for doing this can be…

Quantitative Methods · Quantitative Biology 2025-08-27 Michael J. Plank , Matthew J. Simpson

Predicting query execution time is a fundamental issue underlying many database management tasks. Existing predictors rely on information such as cardinality estimates and system performance constants that are difficult to know exactly. As…

Databases · Computer Science 2014-08-29 Wentao Wu , Xi Wu , Hakan Hacıgümüş , Jeffrey F. Naughton

We show that language models hallucinate not because they fail to detect uncertainty, but because of a failure to integrate it into output generation. Across architectures, uncertain inputs are reliably identified, occupying…

Artificial Intelligence · Computer Science 2026-03-17 Valeria Ruscio , Keiran Thompson

Uncertainty quantification (UQ) is an important component of molecular property prediction, particularly for drug discovery applications where model predictions direct experimental design and where unanticipated imprecision wastes valuable…

Machine Learning · Computer Science 2020-05-21 Lior Hirschfeld , Kyle Swanson , Kevin Yang , Regina Barzilay , Connor W. Coley

Large language models are increasingly used as surrogate models for low-data optimization, but their optimizer-facing prediction and its uncertainty remain poorly understood. We study the surrogate belief elicited from an LLM under sparse…

Computation and Language · Computer Science 2026-05-07 Ge Lei , Samuel J. Cooper

Despite tremendous success of modern neural networks, they are known to be overconfident even when the model encounters inputs with unfamiliar conditions. Detecting such inputs is vital to preventing models from making naive predictions…

Computer Vision and Pattern Recognition · Computer Science 2020-09-07 Jinsol Lee , Ghassan AlRegib

Deep neural networks are powerful tools to detect hidden patterns in data and leverage them to make predictions, but they are not designed to understand uncertainty and estimate reliable probabilities. In particular, they tend to be…

Machine Learning · Statistics 2022-11-10 Bat-Sheva Einbinder , Yaniv Romano , Matteo Sesia , Yanfei Zhou

Regression methods are fundamental for scientific and technological applications. However, fitted models can be highly unreliable outside of their training domain, and hence the quantification of their uncertainty is crucial in many of…

Machine Learning · Statistics 2024-03-05 Filippo Bigi , Sanggyu Chong , Michele Ceriotti , Federico Grasselli

Deep Learning is a consolidated, state-of-the-art Machine Learning tool to fit a function when provided with large data sets of examples. However, in regression tasks, the straightforward application of Deep Learning models provides a point…

Machine Learning · Computer Science 2018-07-25 Axel Brando , Jose A. Rodríguez-Serrano , Mauricio Ciprian , Roberto Maestre , Jordi Vitrià

A rich set of frequentist model averaging methods has been developed, but their applications have largely been limited to point prediction, as measuring prediction uncertainty in general settings remains an open problem. In this paper we…

Econometrics · Economics 2025-10-21 Zhongjun Qu , Wendun Wang , Xiaomeng Zhang

Efficient exploration remains a challenging problem in reinforcement learning, especially for those tasks where rewards from environments are sparse. A commonly used approach for exploring such environments is to introduce some "intrinsic"…

Machine Learning · Computer Science 2020-07-16 Neale Ratzlaff , Qinxun Bai , Li Fuxin , Wei Xu

Distributional models are derived from co-occurrences in a corpus, where only a small proportion of all possible plausible co-occurrences will be observed. This results in a very sparse vector space, requiring a mechanism for inferring…

Computation and Language · Computer Science 2016-08-25 Thomas Kober , Julie Weeds , Jeremy Reffin , David Weir

Recent work has shown that the hidden states of large language models contain signals useful for uncertainty estimation and hallucination detection, motivating a growing interest in efficient probe-based approaches. Yet it remains unclear…

Computation and Language · Computer Science 2026-04-14 Joe Stacey , Hadas Orgad , Kentaro Inui , Benjamin Heinzerling , Nafise Sadat Moosavi

We present an interpretable companion model for any pre-trained black-box classifiers. The idea is that for any input, a user can decide to either receive a prediction from the black-box model, with high accuracy but no explanations, or…

Machine Learning · Statistics 2020-02-12 Danqing Pan , Tong Wang , Satoshi Hara

Reliable predictive uncertainty estimation plays an important role in enabling the deployment of neural networks to safety-critical settings. A popular approach for estimating the predictive uncertainty of neural networks is to define a…

Machine Learning · Statistics 2023-12-29 Tim G. J. Rudner , Zonghao Chen , Yee Whye Teh , Yarin Gal

One problem to solve in the context of information fusion, decision-making, and other artificial intelligence challenges is to compute justified beliefs based on evidence. In real-life examples, this evidence may be inconsistent,…

Artificial Intelligence · Computer Science 2023-06-07 Daira Pinto Prieto , Ronald de Haan , Aybüke Özgün

When a machine learning model is deployed, its predictions can alter its environment, as better informed agents strategize to suit their own interests. With such alterations in mind, existing approaches to uncertainty quantification break.…

Machine Learning · Statistics 2024-11-05 Daniel Csillag , Claudio José Struchiner , Guilherme Tegoni Goedert

Techniques for understanding the functioning of complex machine learning models are becoming increasingly popular, not only to improve the validation process, but also to extract new insights about the data via exploratory analysis. Though…

Machine Learning · Statistics 2018-11-02 Jayaraman J. Thiagarajan , Irene Kim , Rushil Anirudh , Peer-Timo Bremer