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Optimization problems with nonlinear cost functions and combinatorial constraints appear in many real-world applications but remain challenging to solve efficiently compared to their linear counterparts. To bridge this gap, we propose…

Machine Learning · Computer Science 2023-07-20 Aaron Ferber , Taoan Huang , Daochen Zha , Martin Schubert , Benoit Steiner , Bistra Dilkina , Yuandong Tian

Surrogate testing is used widely to determine the nature of the process generating the given empirical sample. In the present study, the usefulness of phase-randomized surrogates, amplitude adjusted Fourier transform (AAFT) and iterated…

Statistical Mechanics · Physics 2007-05-23 Radhakrishnan Nagarajan

Area under ROC (AUC) is an important metric for binary classification and bipartite ranking problems. However, it is difficult to directly optimizing AUC as a learning objective, so most existing algorithms are based on optimizing a…

Machine Learning · Computer Science 2018-05-28 Siwei Lyu , Yiming Ying

The numerical unitarity approach has been important for obtaining reliable QCD predictions for the LHC. Here I discuss the extension of the approach beyond the leading quantum corrections for computing multi-loop amplitudes. The numerical…

High Energy Physics - Phenomenology · Physics 2017-03-27 Harald Ita

We study a family of algorithms, which we refer to as local update methods, that generalize many federated learning and meta-learning algorithms. We prove that for quadratic objectives, local update methods perform stochastic gradient…

Machine Learning · Computer Science 2020-07-03 Zachary Charles , Jakub Konečný

Recent advancements in Markov chain Monte Carlo (MCMC) sampling and surrogate modelling have significantly enhanced the feasibility of Bayesian analysis across engineering fields. However, the selection and integration of surrogate models…

Computational Physics · Physics 2024-11-22 Leon Riccius , Iuri B. C. M. Rocha , Joris Bierkens , Hanne Kekkonen , Frans P. van der Meer

Bayesian formulations of inverse problems are attractive for their ability to incorporate prior knowledge and update probabilistic models as new data become available. Markov chain Monte Carlo (MCMC) methods sample posterior probability…

Geophysics · Physics 2025-05-07 Giovanni Angelo Meles , Stefano Marelli , Niklas Linde

We consider a misspecified optimization problem that requires minimizing of a convex function $f(x;\theta^*)$ in x over a constraint set represented by $h(x;\theta^*)\leq 0$, where $\theta^*$ is an unknown (or misspecified) vector of…

Optimization and Control · Mathematics 2016-08-17 H. Ahmadi , N. S. Aybat , U. V. Shanbhag

The search for signals of new physics at the forthcoming LHC experiments involves the analysis of final states characterised by a high number of hadronic jets or identified particles. Precise theoretical predictions for these processes…

High Energy Physics - Phenomenology · Physics 2009-04-16 Stefan Weinzierl

Physics-informed machine learning surrogates are increasingly explored to accelerate dynamic simulation of generators, converters, and other power grid components. The key question, however, is not only whether a surrogate matches a…

Systems and Control · Electrical Eng. & Systems 2026-03-19 Petros Ellinas , Indrajit Chaudhuri , Johanna Vorwerk , Spyros Chatzivasileiadis

We tackle the problem of quantifying failure probabilities for expensive deterministic computer experiments with stochastic inputs under a fixed budget. The computational cost of the computer simulation prohibits direct Monte Carlo (MC) and…

Methodology · Statistics 2025-07-08 Annie S. Booth , S. Ashwin Renganathan

Amortized Bayesian model comparison (BMC) enables fast probabilistic ranking of models via simulation-based training of neural surrogates. However, the accuracy of neural surrogates deteriorates when simulation models are misspecified; the…

Machine Learning · Statistics 2026-05-13 Šimon Kucharský , Aayush Mishra , Daniel Habermann , Stefan T. Radev , Paul-Christian Bürkner

We present an algorithm to perform trust-region-based optimization for nonlinear unconstrained problems. The method selectively uses function and gradient evaluations at different floating-point precisions to reduce the overall energy…

Optimization and Control · Mathematics 2022-02-18 Richard J Clancy , Matt Menickelly , Jan Hückelheim , Paul Hovland , Prani Nalluri , Rebecca Gjini

Surrogate models - also called emulators - are widely used to facilitate Bayesian inference in settings where computational costs preclude the use of standard posterior inference algorithms. Their deployment is now standard practice across…

Methodology · Statistics 2026-03-17 Andrew Gerard Roberts , Michael C. Dietze , Jonathan H. Huggins

Optimization problems with an auxiliary latent variable structure in addition to the main model parameters occur frequently in computer vision and machine learning. The additional latent variables make the underlying optimization task…

Machine Learning · Computer Science 2020-03-13 Christopher Zach , Huu Le

Optimization models used to make discrete decisions often contain uncertain parameters that are context-dependent and estimated through prediction. To account for the quality of the decision made based on the prediction, decision-focused…

Machine Learning · Computer Science 2024-07-30 Noah Schutte , Krzysztof Postek , Neil Yorke-Smith

Trust and ethical concerns due to the widespread deployment of opaque machine learning (ML) models motivating the need for reliable model explanations. Post-hoc model-agnostic explanation methods addresses this challenge by learning a…

Machine Learning · Computer Science 2026-03-18 Sumedha Chugh , Ranjitha Prasad , Nazreen Shah

Numerous applications in biology, statistics, science, and engineering require generating samples from high-dimensional probability distributions. In recent years, the Hamiltonian Monte Carlo (HMC) method has emerged as a state-of-the-art…

Computational Engineering, Finance, and Science · Computer Science 2024-05-09 Dhruv V. Patel , Jonghyun Lee , Matthew W. Farthing , Peter K. Kitanidis , Eric F. Darve

Models that employ latent variables to capture structure in observed data lie at the heart of many current unsupervised learning algorithms, but exact maximum-likelihood learning for powerful and flexible latent-variable models is almost…

Machine Learning · Statistics 2020-08-18 Li K. Wenliang , Theodore Moskovitz , Heishiro Kanagawa , Maneesh Sahani

The problem of designing learners that provide guarantees that their predictions are provably correct is of increasing importance in machine learning. However, learning theoretic guarantees have only been considered in very specific…

Machine Learning · Computer Science 2023-10-31 Maria-Florina Balcan , Steve Hanneke , Rattana Pukdee , Dravyansh Sharma