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 Bayesian Inference


A Multicollinearity-Aware Signal-Processing Framework for Cross-$ฮฒ$ Identification via X-ray Scattering of Alzheimer's Tissue

arXiv.org Artificial Intelligence

X-ray scattering measurements of in situ human brain tissue encode structural signatures of pathological cross-$ฮฒ$ inclusions, yet systematic exploitation of these data for automated detection remains challenging due to substrate contamination, strong inter-feature correlations, and limited sample sizes. This work develops a three-stage classification framework for identifying cross-$ฮฒ$ structural inclusions-a hallmark of Alzheimer's disease-in X-ray scattering profiles of post-mortem human brain. Stage 1 employs a Bayes-optimal classifier to separate mica substrate from tissue regions on the basis of their distinct scattering signatures. Stage 2 introduces a multicollinearityaware, class-conditional correlation pruning scheme with formal guarantees on the induced Bayes risk and approximation error, thereby reducing redundancy while retaining class-discriminative information. Stage 3 trains a compact neural network on the pruned feature set to detect the presence or absence of cross-$ฮฒ$ fibrillar ordering. The top-performing model, optimized with a composite loss combining Focal and Dice objectives, attains a test F1-score of 84.30% using 11 of 211 candidate features and 174 trainable parameters. The overall framework yields an interpretable, theory-grounded strategy for data-limited classification problems involving correlated, high-dimensional experimental measurements, exemplified here by X-ray scattering profiles of neurodegenerative tissue.


Scaling Law Analysis in Federated Learning: How to Select the Optimal Model Size?

arXiv.org Artificial Intelligence

The recent success of large language models (LLMs) has sparked a growing interest in training large-scale models. As the model size continues to scale, concerns are growing about the depletion of high-quality, well-curated training data. This has led practitioners to explore training approaches like Federated Learning (FL), which can leverage the abundant data on edge devices while maintaining privacy. However, the decentralization of training datasets in FL introduces challenges to scaling large models, a topic that remains under-explored. This paper fills this gap and provides qualitative insights on generalizing the previous model scaling experience to federated learning scenarios. Specifically, we derive a P AC-Bayes (Probably Approximately Correct Bayesian) upper bound for the generalization error of models trained with stochastic algorithms in federated settings and quantify the impact of distributed training data on the optimal model size by finding the analytic solution of model size that minimizes this bound. Our theoretical results demonstrate that the optimal model size has a negative power law relationship with the number of clients if the total training compute is unchanged. Besides, we also find that switching to FL with the same training compute will inevitably reduce the upper bound of generalization performance that the model can achieve through training, and that estimating the optimal model size in federated scenarios should depend on the average training compute across clients. Furthermore, we also empirically validate the correctness of our results with extensive training runs on different models, network settings, and datasets.


Timely Clinical Diagnosis through Active Test Selection

arXiv.org Artificial Intelligence

There is growing interest in using machine learning (ML) to support clinical diagnosis, but most approaches rely on static, fully observed datasets and fail to reflect the sequential, resource-aware reasoning clinicians use in practice. Diagnosis remains complex and error prone, especially in high-pressure or resource-limited settings, underscoring the need for frameworks that help clinicians make timely and cost-effective decisions. We propose ACTMED (Adaptive Clinical Test selection via Model-based Experimental Design), a diagnostic framework that integrates Bayesian Experimental Design (BED) with large language models (LLMs) to better emulate real-world diagnostic reasoning. At each step, ACTMED selects the test expected to yield the greatest reduction in diagnostic uncertainty for a given patient. LLMs act as flexible simulators, generating plausible patient state distributions and supporting belief updates without requiring structured, task-specific training data. Clinicians can remain in the loop; reviewing test suggestions, interpreting intermediate outputs, and applying clinical judgment throughout. We evaluate ACTMED on real-world datasets and show it can optimize test selection to improve diagnostic accuracy, interpretability, and resource use. This represents a step toward transparent, adaptive, and clinician-aligned diagnostic systems that generalize across settings with reduced reliance on domain-specific data.


Can Linear Probes Measure LLM Uncertainty?

arXiv.org Artificial Intelligence

Effective Uncertainty Quantification (UQ) represents a key aspect for reliable deployment of Large Language Models (LLMs) in automated decision-making and beyond. Yet, for LLM generation with multiple choice structure, the state-of-the-art in UQ is still dominated by the naive baseline given by the maximum softmax score. To address this shortcoming, we demonstrate that taking a principled approach via Bayesian statistics leads to improved performance despite leveraging the simplest possible model, namely linear regression. More precisely, we propose to train multiple Bayesian linear models, each predicting the output of a layer given the output of the previous one. Based on the obtained layer-level posterior distributions, we infer the global uncertainty level of the LLM by identifying a sparse combination of distributional features, leading to an efficient UQ scheme. Numerical experiments on various LLMs show consistent improvement over state-of-the-art baselines.


DRAGON: Distributional Rewards Optimize Diffusion Generative Models

arXiv.org Artificial Intelligence

We present Distributional RewArds for Generative OptimizatioN (DRAGON), a versatile framework for fine-tuning media generation models towards a desired outcome. Compared with traditional reinforcement learning with human feedback (RLHF) or pairwise preference approaches such as direct preference optimization (DPO), DRAGON is more flexible. It can optimize reward functions that evaluate either individual examples or distributions of them, making it compatible with a broad spectrum of instance-wise, instance-to-distribution, and distribution-to-distribution rewards. Leveraging this versatility, we construct novel reward functions by selecting an encoder and a set of reference examples to create an exemplar distribution. When cross-modal encoders such as CLAP are used, the reference may be of a different modality (text versus audio). Then, DRAGON gathers online and on-policy generations, scores them with the reward function to construct a positive demonstration set and a negative set, and leverages the contrast between the two finite sets to approximate distributional reward optimization. For evaluation, we fine-tune an audio-domain text-to-music diffusion model with 20 reward functions, including a custom music aesthetics model, CLAP score, Vendi diversity, and Frechet audio distance (FAD). We further compare instance-wise (per-song) and full-dataset FAD settings while ablating multiple FAD encoders and reference sets. Over all 20 target rewards, DRAGON achieves an 81.45% average win rate. Moreover, reward functions based on exemplar sets enhance generations and are comparable to model-based rewards. With an appropriate exemplar set, DRAGON achieves a 60.95% human-voted music quality win rate without training on human preference annotations. DRAGON is a new approach to designing and optimizing reward functions for improving human-perceived quality. Demos at https://ml-dragon.github.io/web


Decision-Making Amid Information-Based Threats in Sociotechnical Systems: A Review

arXiv.org Artificial Intelligence

Technological systems increasingly mediate human information exchange, spanning interactions among humans as well as between humans and artificial agents. The unprecedented scale and reliance on information disseminated through these systems substantially expand the scope of information-based influence that can both enable and undermine sound decision-making. Consequently, understanding and protecting decision-making today faces growing challenges, as individuals and organizations must navigate evolving opportunities and information-based threats across varied domains and information environments. While these risks are widely recognized, research remains fragmented: work evaluating information-based threat phenomena has progressed largely in isolation from foundational studies of human information processing. In this review, we synthesize insights from both domains to identify shared cognitive mechanisms that mediate vulnerability to information-based threats and shape behavioral outcomes. Finally, we outline directions for future research aimed at integrating these perspectives, emphasizing the importance of such integration for mitigating human vulnerabilities and aligning human-machine representations.


Scientific Data Compression and Super-Resolution Sampling

arXiv.org Machine Learning

Modern scientific simulations, observations, and large-scale experiments generate data at volumes that often exceed the limits of storage, processing, and analysis. This challenge drives the development of data reduction methods that efficiently manage massive datasets while preserving essential physical features and quantities of interest. In many scientific workflows, it is also crucial to enable data recovery from compressed representations - a task known as super-resolution - with guarantees on the preservation of key physical characteristics. A notable example is checkpointing and restarting, which is essential for long-running simulations to recover from failures, resume after interruptions, or examine intermediate results. In this work, we introduce a novel framework for scientific data compression and super-resolution, grounded in recent advances in learning exponential families. Our method preserves and quantifies uncertainty in physical quantities of interest and supports flexible trade-offs between compression ratio and reconstruction fidelity.


DIGing--SGLD: Decentralized and Scalable Langevin Sampling over Time--Varying Networks

arXiv.org Machine Learning

Sampling from a target distribution induced by training data is central to Bayesian learning, with Stochastic Gradient Langevin Dynamics (SGLD) serving as a key tool for scalable posterior sampling and decentralized variants enabling learning when data are distributed across a network of agents. This paper introduces DIGing-SGLD, a decentralized SGLD algorithm designed for scalable Bayesian learning in multi-agent systems operating over time-varying networks. Existing decentralized SGLD methods are restricted to static network topologies, and many exhibit steady-state sampling bias caused by network effects, even when full batches are used. DIGing-SGLD overcomes these limitations by integrating Langevin-based sampling with the gradient-tracking mechanism of the DIGing algorithm, originally developed for decentralized optimization over time-varying networks, thereby enabling efficient and bias-free sampling without a central coordinator. To our knowledge, we provide the first finite-time non-asymptotic Wasserstein convergence guarantees for decentralized SGLD-based sampling over time-varying networks, with explicit constants. Under standard strong convexity and smoothness assumptions, DIGing-SGLD achieves geometric convergence to an $O(\sqrtฮท)$ neighborhood of the target distribution, where $ฮท$ is the stepsize, with dependence on the target accuracy matching the best-known rates for centralized and static-network SGLD algorithms using constant stepsize. Numerical experiments on Bayesian linear and logistic regression validate the theoretical results and demonstrate the strong empirical performance of DIGing-SGLD under dynamically evolving network conditions.


Bregman geometry-aware split Gibbs sampling for Bayesian Poisson inverse problems

arXiv.org Machine Learning

This paper proposes a novel Bayesian framework for solving Poisson inverse problems by devising a Monte Carlo sampling algorithm which accounts for the underlying non-Euclidean geometry. To address the challenges posed by the Poisson likelihood -- such as non-Lipschitz gradients and positivity constraints -- we derive a Bayesian model which leverages exact and asymptotically exact data augmentations. In particular, the augmented model incorporates two sets of splitting variables both derived through a Bregman divergence based on the Burg entropy. Interestingly the resulting augmented posterior distribution is characterized by conditional distributions which benefit from natural conjugacy properties and preserve the intrinsic geometry of the latent and splitting variables. This allows for efficient sampling via Gibbs steps, which can be performed explicitly for all conditionals, except the one incorporating the regularization potential. For this latter, we resort to a Hessian Riemannian Langevin Monte Carlo (HRLMC) algorithm which is well suited to handle priors with explicit or easily computable score functions. By operating on a mirror manifold, this Langevin step ensures that the sampling satisfies the positivity constraints and more accurately reflects the underlying problem structure. Performance results obtained on denoising, deblurring, and positron emission tomography (PET) experiments demonstrate that the method achieves competitive performance in terms of reconstruction quality compared to optimization- and sampling-based approaches.


Adaptive Symmetrization of the KL Divergence

arXiv.org Artificial Intelligence

Many tasks in machine learning can be described as or reduced to learning a probability distribution given a finite set of samples. A common approach is to minimize a statistical divergence between the (empirical) data distribution and a parameterized distribution, e.g., a normalizing flow (NF) or an energy-based model (EBM). In this context, the forward KL divergence is a ubiquitous due to its tractability, though its asymmetry may prevent capturing some properties of the target distribution. Symmetric alternatives involve brittle min-max formulations and adversarial training (e.g., generative adversarial networks) or evaluating the reverse KL divergence, as is the case for the symmetric Jeffreys divergence, which is challenging to compute from samples. This work sets out to develop a new approach to minimize the Jeffreys divergence. To do so, it uses a proxy model whose goal is not only to fit the data, but also to assist in optimizing the Jeffreys divergence of the main model. This joint training task is formulated as a constrained optimization problem to obtain a practical algorithm that adapts the models priorities throughout training. We illustrate how this framework can be used to combine the advantages of NFs and EBMs in tasks such as density estimation, image generation, and simulation-based inference.