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Gaussian processes are the gold standard for many real-world modeling problems, especially in cases where a model's success hinges upon its ability to faithfully represent predictive uncertainty. These problems typically exist as parts of…

Vehicle models have a long history of research and as of today are able to model the involved physics in a reasonable manner. However, each new vehicle has its new characteristics or parameters. The identification of these is the main task…

Computational Engineering, Finance, and Science · Computer Science 2024-12-11 Nicola Henkelmann , Stephan Rhode , Johannes von Keler

Recently, large language models (LLMs) have shown surprising performance in task-specific workloads as well as general tasks with the given prompts. However, to achieve unprecedented performance, recent LLMs use billions to trillions of…

Machine Learning · Computer Science 2024-06-21 Geonhwa Jeong , Po-An Tsai , Stephen W. Keckler , Tushar Krishna

Predictive modelling represents an emerging field that combines existing and novel methodologies aimed to rapidly understand physical mechanisms and concurrently develop new materials, processes and structures. In the current study,…

Semi- and non-parametric mixture of regressions are a very useful flexible class of mixture of regressions in which some or all of the parameters are non-parametric functions of the covariates. These models are, however, based on the…

Methodology · Statistics 2026-01-21 Peterson Mambondimumwe , Sphiwe B. Skhosana , Najmeh Nakhaei Rad

Deep generative models with latent variables have been used lately to learn joint representations and generative processes from multi-modal data. These two learning mechanisms can, however, conflict with each other and representations can…

Machine Learning · Computer Science 2023-01-24 Rogelio A. Mancisidor , Michael Kampffmeyer , Kjersti Aas , Robert Jenssen

Experience in the physical sciences suggests that the only realistic means of understanding complex systems is through the use of mathematical models. Typically, this has come to mean the identification of quantitative models expressed as…

Artificial Intelligence · Computer Science 2011-11-02 George M. Coghill , Ross D. King , Ashwin Srinivasan

Determining the optimal model for a given task often requires training multiple models from scratch, which becomes impractical as dataset and model sizes grow. A more efficient alternative is to expand smaller pre-trained models, but this…

Machine Learning · Computer Science 2025-06-17 Pranshu Malviya , Jerry Huang , Aristide Baratin , Quentin Fournier , Sarath Chandar

Mixed Precision Quantization (MPQ) has become an essential technique for optimizing neural network by determining the optimal bitwidth per layer. Existing MPQ methods, however, face a major hurdle: they require a computationally expensive…

Computer Vision and Pattern Recognition · Computer Science 2025-05-20 Lianbo Ma , Jianlun Ma , Yuee Zhou , Guoyang Xie , Qiang He , Zhichao Lu

The enormous structural and chemical diversity of metal-organic frameworks (MOFs) forces researchers to actively use simulation techniques on an equal footing with experiments. MOFs are widely known for outstanding adsorption properties, so…

Materials Science · Physics 2021-11-22 Vadim V. Korolev , Yurii M. Nevolin , Thomas A. Manz , Pavel V. Protsenko

Over the past decades, researchers and ML practitioners have come up with better and better ways to build, understand and improve the quality of ML models, but mostly under the key assumption that the training data is distributed…

Machine Learning · Computer Science 2019-10-14 Yeounoh Chung , Peter J. Haas , Eli Upfal , Tim Kraska

Accurate approximation of probability measures is essential in numerical applications. This paper explores the quantization of probability measures using the maximum mean discrepancy (MMD) distance as a guiding metric. We first investigate…

Optimization and Control · Mathematics 2025-03-18 Zahra Mehraban , Alois Pichler

Medical image classification is a critical task in healthcare, enabling accurate and timely diagnosis. However, deploying deep learning models on resource-constrained edge devices presents significant challenges due to computational and…

Image and Video Processing · Electrical Eng. & Systems 2025-12-30 Mahsa Lavaei , Zahra Abadi , Salar Beigzad , Alireza Maleki

There is a growing need for investigating how machine learning models operate. With this work, we aim to understand trained machine learning models by questioning their data preferences. We propose a mathematical framework that allows us to…

Machine Learning · Computer Science 2025-12-22 Eren Mehmet Kıral , Nurşen Aydın , Ş. İlker Birbil

Data-driven Model Predictive Control (MPC), where the system model is learned from data with machine learning, has recently gained increasing interests in the control community. Gaussian Processes (GP), as a type of statistical models, are…

Systems and Control · Computer Science 2019-10-03 Truong X. Nghiem

This paper presents a new model called infinite mixtures of multivariate Gaussian processes, which can be used to learn vector-valued functions and applied to multitask learning. As an extension of the single multivariate Gaussian process,…

Machine Learning · Computer Science 2013-07-29 Shiliang Sun

Machine learning (ML)-accelerated discovery requires large amounts of high-fidelity data to reveal predictive structure-property relationships. For many properties of interest in materials discovery, the challenging nature and high cost of…

Chemical Physics · Physics 2021-11-04 Aditya Nandy , Chenru Duan , Heather J. Kulik

Evaluating generative models for synthetic medical imaging is crucial yet challenging, especially given the high standards of fidelity, anatomical accuracy, and safety required for clinical applications. Standard evaluation of generated…

Image and Video Processing · Electrical Eng. & Systems 2025-05-13 Yash Deo , Yan Jia , Toni Lassila , William A. P. Smith , Tom Lawton , Siyuan Kang , Alejandro F. Frangi , Ibrahim Habli

The Residual Quantization (RQ) framework is revisited where the quantization distortion is being successively reduced in multi-layers. Inspired by the reverse-water-filling paradigm in rate-distortion theory, an efficient regularization on…

Machine Learning · Computer Science 2017-05-02 Sohrab Ferdowsi , Slava Voloshynovskiy , Dimche Kostadinov

In recent years, many industries have utilized machine learning (ML) models in their systems. Ideally, ML models should be trained on and applied to data from the same distributions. However, the data evolves over time in many application…

Software Engineering · Computer Science 2025-05-21 Forough Majidi , Foutse Khomh , Heng Li , Amin Nikanjam