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We develop an encompassing framework for matching, covariate balancing, and doubly-robust methods for causal inference from observational data called generalized optimal matching (GOM). The framework is given by generalizing a new…

Machine Learning · Statistics 2017-10-30 Nathan Kallus

In complex systems with many degrees of freedom such as peptides and proteins there exist a huge number of local-minimum-energy states. Conventional simulations in the canonical ensemble are of little use, because they tend to get trapped…

Statistical Mechanics · Physics 2007-05-23 Ayori Mitsutake , Yuji Sugita , Yuko Okamoto

Generalized additive models (GAMs) provide a way to blend parametric and non-parametric (function approximation) techniques together, making them flexible tools suitable for many modeling problems. For instance, GAMs can be used to…

Methodology · Statistics 2023-03-07 Antti Solonen , Stratos Staboulis

We introduce marginalization models (MAMs), a new family of generative models for high-dimensional discrete data. They offer scalable and flexible generative modeling by explicitly modeling all induced marginal distributions.…

Machine Learning · Computer Science 2024-10-08 Sulin Liu , Peter J. Ramadge , Ryan P. Adams

This paper studies the application of the generalized method of moments (GMM) to multi-reference alignment (MRA): the problem of estimating a signal from its circularly-translated and noisy copies. We begin by proving that the GMM estimator…

Signal Processing · Electrical Eng. & Systems 2022-04-06 Asaf Abas , Tamir Bendory , Nir Sharon

Energy system optimization models are increasing in scope and resolution, yielding large and challenging linear programs. For a long time, the standard way to address such problems has relied on shared-memory interior-point methods (IPM),…

Optimization and Control · Mathematics 2026-05-07 Janina Zittel , Annika Buchholz , Michael Bussieck , Frederik Fiand , Thorsten Koch , Lukas Mehl , Niels Lindner , Manuel Wetzel

Following a series of high-profile drug safety disasters in recent years, many countries are redoubling their efforts to ensure the safety of licensed medical products. Large-scale observational databases such as claims databases or…

Computation · Statistics 2012-08-07 Marc A. Suchard , Shawn E. Simpson , Ivan Zorych , Patrick Ryan , David Madigan

Constraint Programming (CP) has been successfully applied to both constraint satisfaction and constraint optimization problems. A wide variety of specialized global constraints provide critical assistance in achieving a good model that can…

Artificial Intelligence · Computer Science 2007-05-23 Peter Tiedemann , Henrik Reif Andersen , Rasmus Pagh

Polyspectral estimation is a problem of great importance in the analysis of nonlinear time series that has applications in biomedical signal processing, communications, geophysics, image, radar, sonar and speech processing, etc. Higher…

Distributed, Parallel, and Cluster Computing · Computer Science 2018-05-31 Abdullah-Al Mamun , Zigeng Wang , Xingyu Cai , Nalini Ravishanker , Sanguthevar Rajasekaran

Tensor processing is the cornerstone of modern technological advancements, powering critical applications in data analytics and artificial intelligence. While optical computing offers exceptional advantages in bandwidth, parallelism, and…

The Generalized Method of Moments (GMM) is a partition of unity based technique for solving electromagnetic and acoustic boundary integral equations. Past work on the GMM for electromagnetics was confined to geometries modeled by piecewise…

Computational Physics · Physics 2015-06-18 Daniel Dault , Naveen V. Nair , Jie Li , Balasubramaniam Shanker

We show that memory-augmented Transformers can implement the entire class of linear first-order methods (LFOMs), a class that contains gradient descent (GD) and more advanced methods such as conjugate gradient descent (CGD), momentum…

Machine Learning · Computer Science 2025-02-04 Sanchayan Dutta , Suvrit Sra

In this contribution, we focus on the Reynolds-Averaged Navier-Stokes (RANS) models and their exploitation to build reliable reduced order models to further accelerate predictions for real-time applications and many-query scenarios.…

Fluid Dynamics · Physics 2025-10-09 Davide Oberto , Maria Strazzullo , Stefano Berrone

Optimal modulation (OM) schemes for Gaussian channels with peak and average power constraints are known to require nonuniform probability distributions over signal points, which presents practical challenges. An established way to map…

Information Theory · Computer Science 2022-11-01 Basak Ozaydin , Muriel Médard , Ken Duffy

Contextual optimization enhances decision quality by leveraging side information to improve predictions of uncertain parameters. However, existing approaches face significant challenges when dealing with multimodal or mixtures of…

Optimization and Control · Mathematics 2025-09-19 YoungChul Yoon , Grani A. Hanasusanto , Yijie Wang

A scale mixture of normals is a distribution formed by mixing a collection of normal distributions with fixed mean but different variances. A generalized gamma scale mixture draws the variances from a generalized gamma distribution.…

Since Pearson [Philosophical Transactions of the Royal Society of London. A, 185 (1894), pp. 71-110] first applied the method of moments (MM) for modeling data as a mixture of one-dimensional Gaussians, moment-based estimation methods have…

Machine Learning · Computer Science 2025-07-29 Liu Zhang , Oscar Mickelin , Sheng Xu , Amit Singer

Mass spectrometry, commonly used for protein identification, generates a massive number of spectra that need to be matched against a large database. In reality, most of them remain unidentified or mismatched due to unexpected…

Distributed, Parallel, and Cluster Computing · Computer Science 2023-01-03 Jaeyoung Kang , Weihong Xu , Wout Bittremieux , Tajana Rosing

We propose new sequential sorting operations by adapting techniques and methods used for designing parallel sorting algorithms. Although the norm is to parallelize a sequential algorithm to improve performance, we adapt a contrarian…

Data Structures and Algorithms · Computer Science 2016-09-01 Alexandros V Gerbessiotis

In this study, we address the gradient-based domain generalization problem, where predictors aim for consistent gradient directions across different domains. Existing methods have two main challenges. First, minimization of gradient…

Machine Learning · Computer Science 2025-07-22 Khoi Do , Duong Nguyen , Nam-Khanh Le , Quoc-Viet Pham , Binh-Son Hua , Won-Joo Hwang