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Precise estimation of downstream performance in large language models (LLMs) prior to training is essential for guiding their development process. Scaling laws analysis utilizes the statistics of a series of significantly smaller sampling…

Computation and Language · Computer Science 2025-04-09 Yangyi Chen , Binxuan Huang , Yifan Gao , Zhengyang Wang , Jingfeng Yang , Heng Ji

We propose a novel approach to perform approximate Bayesian inference in complex models such as Bayesian neural networks. The approach is more scalable to large data than Markov Chain Monte Carlo, it embraces more expressive models than…

Machine Learning · Statistics 2022-09-07 Joel Janek Dabrowski , Daniel Edward Pagendam

Prior-Data Fitted Networks (PFNs) enable amortized Bayesian inference in a single forward pass, yet their internal representations remain opaque. It is unknown whether PFNs encode identifiable Bayesian structure or merely memorize…

Machine Learning · Computer Science 2026-05-14 Kaustubh Sharma , Srijan Tiwari , Ojasva Nema , Parikshit Pareek

Achieving robust uncertainty quantification for deep neural networks represents an important requirement in many real-world applications of deep learning such as medical imaging where it is necessary to assess the reliability of a neural…

Machine Learning · Computer Science 2024-03-15 Tim Rensmeyer , Oliver Niggemann

Optimal power flow (OPF) is one of the fundamental tasks for power system operations. While machine learning (ML) approaches such as deep neural networks (DNNs) have been widely studied to enhance OPF solution speed and performance, their…

Machine Learning · Computer Science 2026-01-07 Xinyi Liu , Xuan He , Yize Chen

We present a method for learning dynamics of complex physical processes described by time-dependent nonlinear partial differential equations (PDEs). Our particular interest lies in extrapolating solutions in time beyond the range of…

Machine Learning · Computer Science 2020-12-07 Jungeun Kim , Kookjin Lee , Dongeun Lee , Sheo Yon Jin , Noseong Park

Bayesian neural networks provide a direct and natural way to extend standard deep neural networks to support probabilistic deep learning through the use of probabilistic layers that, traditionally, encode weight (and bias) uncertainty. In…

Machine Learning · Computer Science 2021-07-16 Daniel T. Chang

Prior-Fitted Networks (PFNs) amortize Bayesian prediction by meta-learning over a synthetic task prior, but their standard output is a posterior predictive distribution over noisy observations. For sequential decision-making, such as active…

Machine Learning · Statistics 2026-05-08 Richard Bergna , Stefan Depeweg , José Miguel Hernández-Lobato

Simulation-based inference (SBI) offers a flexible and general approach to performing Bayesian inference: In SBI, a neural network is trained on synthetic data simulated from a model and used to rapidly infer posterior distributions for…

Machine Learning · Computer Science 2025-10-28 Julius Vetter , Manuel Gloeckler , Daniel Gedon , Jakob H. Macke

The use of machine learning models in system identification has increased due to their ability to approximate complex nonlinear dynamics with high accuracy. However, often it is not clear how the performance of trained models scales with…

Optimization and Control · Mathematics 2026-03-26 Marco Roschkowski , Karim Cherifi , Hannes Gernandt

Machine learning models perform well across domains such as diagnostics, weather forecasting, NLP, and autonomous driving, but their limited uncertainty handling restricts use in safety-critical settings. Traditional neural networks often…

Machine Learning · Computer Science 2025-12-01 Bernhard Klein , Falk Selker , Hendrik Borras , Sophie Steger , Franz Pernkopf , Holger Fröning

Isotropic Gaussian priors are the de facto standard for modern Bayesian neural network inference. However, it is unclear whether these priors accurately reflect our true beliefs about the weight distributions or give optimal performance. To…

Scaling laws predict the loss of a target machine learning model by extrapolating from easier-to-train models with fewer parameters or smaller training sets. This provides an efficient way for practitioners and researchers alike to compare…

Machine Learning · Computer Science 2025-06-04 Leshem Choshen , Yang Zhang , Jacob Andreas

Foundation models for tabular data, such as the Tabular Prior-data Fitted Network (TabPFN), are pre-trained on a massive number of synthetic datasets generated by structural causal models (SCM). They leverage in-context learning to offer…

Machine Learning · Computer Science 2026-01-28 Qinyi Liu , Mohammad Khalil , Naman Goel

Bayesian decision theory provides an elegant framework for acting optimally under uncertainty when tractable posterior distributions are available. Modern Bayesian models, however, typically involve intractable posteriors that are…

Machine Learning · Computer Science 2021-06-15 Meet P. Vadera , Soumya Ghosh , Kenney Ng , Benjamin M. Marlin

This paper explores the intricate behavior of deep neural networks (DNNs) through the lens of neuron activation dynamics. We propose a probabilistic framework that can analyze models' neuron activation patterns as a stochastic process,…

Artificial Intelligence · Computer Science 2024-12-25 Yizhou Zhang , Yang Sui

Scaling up neural models has yielded significant advancements in a wide array of tasks, particularly in language generation. Previous studies have found that the performance of neural models frequently adheres to predictable scaling laws,…

Information Retrieval · Computer Science 2024-07-16 Yan Fang , Jingtao Zhan , Qingyao Ai , Jiaxin Mao , Weihang Su , Jia Chen , Yiqun Liu

Inverse problems arise almost everywhere in science and engineering where we need to infer on a quantity from indirect observation. The cases of medical, biomedical, and industrial imaging systems are the typical examples. A very high…

Machine Learning · Computer Science 2025-02-20 Ali Mohammad-Djafari

Prior-data fitted networks (PFNs) are a promising alternative to time-consuming Gaussian process (GP) inference for creating fast surrogates of physical systems. PFN reduces the computational burden of GP-training by replacing Bayesian…

Machine Learning · Computer Science 2025-12-02 Kaustubh Sharma , Simardeep Singh , Parikshit Pareek

For three decades statistical mechanics has been providing a framework to analyse neural networks. However, the theoretically tractable models, e.g., perceptrons, random features models and kernel machines, or multi-index models and…

Machine Learning · Statistics 2025-06-02 Jean Barbier , Francesco Camilli , Minh-Toan Nguyen , Mauro Pastore , Rudy Skerk