arXiv subjects

Padhraic Smyth

Publications and source records attributed to Padhraic Smyth.

At least 37 records · Page 2Linked to original sources

arXiv2025

What Large Language Models Know and What People Think They Know

As artificial intelligence (AI) systems, particularly large language models (LLMs), become increasingly integrated into decision-making processes, the ability to trust their outputs is crucial. To earn human trust, LLMs must be well calibrated such that they can accurately assess and communicate the likelihood of their predictions being correct. Whereas recent work has focused on LLMs' internal confidence, less is understood about how effectively they convey uncertainty to users. Here we explore the calibration gap, which refers to the difference between human confidence in LLM-generated answers and the models' actual confidence, and the discrimination gap, which reflects how well humans and models can distinguish between correct and incorrect answers. Our experiments with multiple-choice and short-answer questions reveal that users tend to overestimate the accuracy of LLM responses when provided with default explanations. Moreover, longer explanations increased user confidence, even when the extra length did not improve answer accuracy. By adjusting LLM explanations to better reflect the models' internal confidence, both the calibration gap and the discrimination gap narrowed, significantly improving user perception of LLM accuracy. These findings underscore the importance of accurate uncertainty communication and highlight the effect of explanation length in influencing user trust in AI-assisted decision-making environments. Code and Data can be found at https://osf.io/y7pr6/ . Journal publication can be found on Nature Machine Intelligence at https://www.nature.com/articles/s42256-024-00976-7 .

cs.LG↗

arXiv2025

ELBOing Stein: Variational Bayes with Stein Mixture Inference

Stein variational gradient descent (SVGD) [Liu and Wang, 2016] performs approximate Bayesian inference by representing the posterior with a set of particles. However, SVGD suffers from variance collapse, i.e. poor predictions due to underestimating uncertainty [Ba et al., 2021], even for moderately-dimensional models such as small Bayesian neural networks (BNNs). To address this issue, we generalize SVGD by letting each particle parameterize a component distribution in a mixture model. Our method, Stein Mixture Inference (SMI), optimizes a lower bound to the evidence (ELBO) and introduces user-specified guides parameterized by particles. SMI extends the Nonlinear SVGD framework [Wang and Liu, 2019] to the case of variational Bayes. SMI effectively avoids variance collapse, judging by a previously described test developed for this purpose, and performs well on standard data sets. In addition, SMI requires considerably fewer particles than SVGD to accurately estimate uncertainty for small BNNs. The synergistic combination of NSVGD, ELBO optimization and user-specified guides establishes a promising approach towards variational Bayesian inference in the case of tall and wide data.

cs.LG↗

arXiv2024

Perceptions of Linguistic Uncertainty by Language Models and Humans

_Uncertainty expressions_ such as "probably" or "highly unlikely" are pervasive in human language. While prior work has established that there is population-level agreement in terms of how humans quantitatively interpret these expressions, there has been little inquiry into the abilities of language models in the same context. In this paper, we investigate how language models map linguistic expressions of uncertainty to numerical responses. Our approach assesses whether language models can employ theory of mind in this setting: understanding the uncertainty of another agent about a particular statement, independently of the model's own certainty about that statement. We find that 7 out of 10 models are able to map uncertainty expressions to probabilistic responses in a human-like manner. However, we observe systematically different behavior depending on whether a statement is actually true or false. This sensitivity indicates that language models are substantially more susceptible to bias based on their prior knowledge (as compared to humans). These findings raise important questions and have broad implications for human-AI and AI-AI communication.

cs.CL↗

arXiv2024

Benchmark Data Repositories for Better Benchmarking

In machine learning research, it is common to evaluate algorithms via their performance on standard benchmark datasets. While a growing body of work establishes guidelines for -- and levies criticisms at -- data and benchmarking practices in machine learning, comparatively less attention has been paid to the data repositories where these datasets are stored, documented, and shared. In this paper, we analyze the landscape of these $\textit{benchmark data repositories}$ and the role they can play in improving benchmarking. This role includes addressing issues with both datasets themselves (e.g., representational harms, construct validity) and the manner in which evaluation is carried out using such datasets (e.g., overemphasis on a few datasets and metrics, lack of reproducibility). To this end, we identify and discuss a set of considerations surrounding the design and use of benchmark data repositories, with a focus on improving benchmarking practices in machine learning.

cs.LG↗

arXiv2024

A Generative Diffusion Model for Probabilistic Ensembles of Precipitation Maps Conditioned on Multisensor Satellite Observations

A generative diffusion model is used to produce probabilistic ensembles of precipitation intensity maps at the 1-hour 5-km resolution. The generation is conditioned on infrared and microwave radiometric measurements from the GOES and DMSP satellites and is trained with merged ground radar and gauge data over southeastern United States. The generated precipitation maps reproduce the spatial autocovariance and other multiscale statistical properties of the gauge-radar reference fields on average. Conditioning the generation on the satellite measurements allows us to constrain the magnitude and location of each generated precipitation feature. The mean of the 128- member ensemble shows high spatial coherence with the reference fields with 0.82 linear correlation between the two. On average, the coherence between any two ensemble members is approximately the same as the coherence between any ensemble member and the ground reference, attesting that the ensemble dispersion is a proper measure of the estimation uncertainty. From the generated ensembles we can easily derive the probability of the precipitation intensity exceeding any given intensity threshold, at the 5-km resolution of the generation or at any desired aggregated resolution.

physics.ao-ph↗

arXiv2024

Anomaly Detection of Tabular Data Using LLMs

Large language models (LLMs) have shown their potential in long-context understanding and mathematical reasoning. In this paper, we study the problem of using LLMs to detect tabular anomalies and show that pre-trained LLMs are zero-shot batch-level anomaly detectors. That is, without extra distribution-specific model fitting, they can discover hidden outliers in a batch of data, demonstrating their ability to identify low-density data regions. For LLMs that are not well aligned with anomaly detection and frequently output factual errors, we apply simple yet effective data-generating processes to simulate synthetic batch-level anomaly detection datasets and propose an end-to-end fine-tuning strategy to bring out the potential of LLMs in detecting real anomalies. Experiments on a large anomaly detection benchmark (ODDS) showcase i) GPT-4 has on-par performance with the state-of-the-art transductive learning-based anomaly detection methods and ii) the efficacy of our synthetic dataset and fine-tuning strategy in aligning LLMs to this task.

cs.LG↗

arXiv2024

Dynamic Conditional Optimal Transport through Simulation-Free Flows

We study the geometry of conditional optimal transport (COT) and prove a dynamical formulation which generalizes the Benamou-Brenier Theorem. Equipped with these tools, we propose a simulation-free flow-based method for conditional generative modeling. Our method couples an arbitrary source distribution to a specified target distribution through a triangular COT plan, and a conditional generative model is obtained by approximating the geodesic path of measures induced by this COT plan. Our theory and methods are applicable in infinite-dimensional settings, making them well suited for a wide class of Bayesian inverse problems. Empirically, we demonstrate that our method is competitive on several challenging conditional generation tasks, including an infinite-dimensional inverse problem.

cs.LG↗

arXiv2024

Probabilistic Modeling for Sequences of Sets in Continuous-Time

Neural marked temporal point processes have been a valuable addition to the existing toolbox of statistical parametric models for continuous-time event data. These models are useful for sequences where each event is associated with a single item (a single type of event or a "mark") -- but such models are not suited for the practical situation where each event is associated with a set of items. In this work, we develop a general framework for modeling set-valued data in continuous-time, compatible with any intensity-based recurrent neural point process model. In addition, we develop inference methods that can use such models to answer probabilistic queries such as "the probability of item $A$ being observed before item $B$," conditioned on sequence history. Computing exact answers for such queries is generally intractable for neural models due to both the continuous-time nature of the problem setting and the combinatorially-large space of potential outcomes for each event. To address this, we develop a class of importance sampling methods for querying with set-based sequences and demonstrate orders-of-magnitude improvements in efficiency over direct sampling via systematic experiments with four real-world datasets. We also illustrate how to use this framework to perform model selection using likelihoods that do not involve one-step-ahead prediction.

cs.LG↗

arXiv2023

Bayesian Online Learning for Consensus Prediction

Given a pre-trained classifier and multiple human experts, we investigate the task of online classification where model predictions are provided for free but querying humans incurs a cost. In this practical but under-explored setting, oracle ground truth is not available. Instead, the prediction target is defined as the consensus vote of all experts. Given that querying full consensus can be costly, we propose a general framework for online Bayesian consensus estimation, leveraging properties of the multivariate hypergeometric distribution. Based on this framework, we propose a family of methods that dynamically estimate expert consensus from partial feedback by producing a posterior over expert and model beliefs. Analyzing this posterior induces an interpretable trade-off between querying cost and classification performance. We demonstrate the efficacy of our framework against a variety of baselines on CIFAR-10H and ImageNet-16H, two large-scale crowdsourced datasets.

cs.LG↗

arXiv2023

Functional Flow Matching

We propose Functional Flow Matching (FFM), a function-space generative model that generalizes the recently-introduced Flow Matching model to operate in infinite-dimensional spaces. Our approach works by first defining a path of probability measures that interpolates between a fixed Gaussian measure and the data distribution, followed by learning a vector field on the underlying space of functions that generates this path of measures. Our method does not rely on likelihoods or simulations, making it well-suited to the function space setting. We provide both a theoretical framework for building such models and an empirical evaluation of our techniques. We demonstrate through experiments on several real-world benchmarks that our proposed FFM method outperforms several recently proposed function-space generative models.

cs.LG↗

arXiv2023

Zero-Shot Anomaly Detection via Batch Normalization

Anomaly detection (AD) plays a crucial role in many safety-critical application domains. The challenge of adapting an anomaly detector to drift in the normal data distribution, especially when no training data is available for the "new normal," has led to the development of zero-shot AD techniques. In this paper, we propose a simple yet effective method called Adaptive Centered Representations (ACR) for zero-shot batch-level AD. Our approach trains off-the-shelf deep anomaly detectors (such as deep SVDD) to adapt to a set of inter-related training data distributions in combination with batch normalization, enabling automatic zero-shot generalization for unseen AD tasks. This simple recipe, batch normalization plus meta-training, is a highly effective and versatile tool. Our theoretical results guarantee the zero-shot generalization for unseen AD tasks; our empirical results demonstrate the first zero-shot AD results for tabular data and outperform existing methods in zero-shot anomaly detection and segmentation on image data from specialized domains. Code is at https://github.com/aodongli/zero-shot-ad-via-batch-norm

cs.LG↗

arXiv2023

Deep Anomaly Detection under Labeling Budget Constraints

Selecting informative data points for expert feedback can significantly improve the performance of anomaly detection (AD) in various contexts, such as medical diagnostics or fraud detection. In this paper, we determine a set of theoretical conditions under which anomaly scores generalize from labeled queries to unlabeled data. Motivated by these results, we propose a data labeling strategy with optimal data coverage under labeling budget constraints. In addition, we propose a new learning framework for semi-supervised AD. Extensive experiments on image, tabular, and video data sets show that our approach results in state-of-the-art semi-supervised AD performance under labeling budget constraints.

cs.LG↗

arXiv2023

Capturing Humans' Mental Models of AI: An Item Response Theory Approach

Improving our understanding of how humans perceive AI teammates is an important foundation for our general understanding of human-AI teams. Extending relevant work from cognitive science, we propose a framework based on item response theory for modeling these perceptions. We apply this framework to real-world experiments, in which each participant works alongside another person or an AI agent in a question-answering setting, repeatedly assessing their teammate's performance. Using this experimental data, we demonstrate the use of our framework for testing research questions about people's perceptions of both AI agents and other people. We contrast mental models of AI teammates with those of human teammates as we characterize the dimensionality of these mental models, their development over time, and the influence of the participants' own self-perception. Our results indicate that people expect AI agents' performance to be significantly better on average than the performance of other humans, with less variation across different types of problems. We conclude with a discussion of the implications of these findings for human-AI interaction.

cs.LG↗

arXiv2023

Variable-Based Calibration for Machine Learning Classifiers

The deployment of machine learning classifiers in high-stakes domains requires well-calibrated confidence scores for model predictions. In this paper we introduce the notion of variable-based calibration to characterize calibration properties of a model with respect to a variable of interest, generalizing traditional score-based metrics such as expected calibration error (ECE). In particular, we find that models with near-perfect ECE can exhibit significant miscalibration as a function of features of the data. We demonstrate this phenomenon both theoretically and in practice on multiple well-known datasets, and show that it can persist after the application of existing calibration methods. To mitigate this issue, we propose strategies for detection, visualization, and quantification of variable-based calibration error. We then examine the limitations of current score-based calibration methods and explore potential modifications. Finally, we discuss the implications of these findings, emphasizing that an understanding of calibration beyond simple aggregate measures is crucial for endeavors such as fairness and model interpretability.

cs.LG↗

arXiv2023

Diffusion Generative Models in Infinite Dimensions

Diffusion generative models have recently been applied to domains where the available data can be seen as a discretization of an underlying function, such as audio signals or time series. However, these models operate directly on the discretized data, and there are no semantics in the modeling process that relate the observed data to the underlying functional forms. We generalize diffusion models to operate directly in function space by developing the foundational theory for such models in terms of Gaussian measures on Hilbert spaces. A significant benefit of our function space point of view is that it allows us to explicitly specify the space of functions we are working in, leading us to develop methods for diffusion generative modeling in Sobolev spaces. Our approach allows us to perform both unconditional and conditional generation of function-valued data. We demonstrate our methods on several synthetic and real-world benchmarks.

cs.LG↗

arXiv2022

Probabilistic Querying of Continuous-Time Event Sequences

Continuous-time event sequences, i.e., sequences consisting of continuous time stamps and associated event types ("marks"), are an important type of sequential data with many applications, e.g., in clinical medicine or user behavior modeling. Since these data are typically modeled autoregressively (e.g., using neural Hawkes processes or their classical counterparts), it is natural to ask questions about future scenarios such as "what kind of event will occur next" or "will an event of type $A$ occur before one of type $B$". Unfortunately, some of these queries are notoriously hard to address since current methods are limited to naive simulation, which can be highly inefficient. This paper introduces a new typology of query types and a framework for addressing them using importance sampling. Example queries include predicting the $n^\text{th}$ event type in a sequence and the hitting time distribution of one or more event types. We also leverage these findings further to be applicable for estimating general "$A$ before $B$" type of queries. We prove theoretically that our estimation method is effectively always better than naive simulation and show empirically based on three real-world datasets that it is on average 1,000 times more efficient than existing approaches.

stat.ML↗

arXiv2022

Predictive Querying for Autoregressive Neural Sequence Models

In reasoning about sequential events it is natural to pose probabilistic queries such as "when will event A occur next" or "what is the probability of A occurring before B", with applications in areas such as user modeling, medicine, and finance. However, with machine learning shifting towards neural autoregressive models such as RNNs and transformers, probabilistic querying has been largely restricted to simple cases such as next-event prediction. This is in part due to the fact that future querying involves marginalization over large path spaces, which is not straightforward to do efficiently in such models. In this paper we introduce a general typology for predictive queries in neural autoregressive sequence models and show that such queries can be systematically represented by sets of elementary building blocks. We leverage this typology to develop new query estimation methods based on beam search, importance sampling, and hybrids. Across four large-scale sequence datasets from different application domains, as well as for the GPT-2 language model, we demonstrate the ability to make query answering tractable for arbitrary queries in exponentially-large predictive path-spaces, and find clear differences in cost-accuracy tradeoffs between search and sampling methods.

cs.LG↗

arXiv2022

Fair Generalized Linear Models with a Convex Penalty

Despite recent advances in algorithmic fairness, methodologies for achieving fairness with generalized linear models (GLMs) have yet to be explored in general, despite GLMs being widely used in practice. In this paper we introduce two fairness criteria for GLMs based on equalizing expected outcomes or log-likelihoods. We prove that for GLMs both criteria can be achieved via a convex penalty term based solely on the linear components of the GLM, thus permitting efficient optimization. We also derive theoretical properties for the resulting fair GLM estimator. To empirically demonstrate the efficacy of the proposed fair GLM, we compare it with other well-known fair prediction methods on an extensive set of benchmark datasets for binary classification and regression. In addition, we demonstrate that the fair GLM can generate fair predictions for a range of response variables, other than binary and continuous outcomes.

stat.ML↗