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We introduce an RG-inspired coarse-graining for extracting the collective features of data. The key to successful coarse-graining lies in finding appropriate pairs of data sets. We coarse-grain the two closest data in a regular real-space…

Data Analysis, Statistics and Probability · Physics 2023-07-19 Jonathan Landy , Tsvi Tlusty , YeongKyu Lee , YongSeok Jho

We present a loss function for neural networks that encompasses an idea of trivial versus non-trivial predictions, such that the network jointly determines its own prediction goals and learns to satisfy them. This permits the network to…

Artificial Intelligence · Computer Science 2016-12-15 Nicholas Guttenberg , Martin Biehl , Ryota Kanai

Identifying the relevant coarse-grained degrees of freedom in a complex physical system is a key stage in developing powerful effective theories in and out of equilibrium. The celebrated renormalization group provides a framework for this…

Statistical Mechanics · Physics 2024-11-27 Doruk Efe Gökmen , Zohar Ringel , Sebastian D. Huber , Maciej Koch-Janusz

Data augmentation is a cornerstone technique in deep learning, widely used to improve model generalization. Traditional methods like random cropping and color jittering, as well as advanced techniques such as CutOut, Mixup, and CutMix, have…

Computer Vision and Pattern Recognition · Computer Science 2025-02-14 Jingyang Li , Jiachun Pan , Kim-Chuan Toh , Pan Zhou

Simulations of condensed matter systems often focus on the dynamics of a few distinguished components but require integrating the dynamics of the full system. A prime example is a molecular dynamics simulation of a (macro)molecule in…

Computational Physics · Physics 2024-03-12 Mauricio J. del Razo , Daan Crommelin , Peter G. Bolhuis

Regression models usually tend to recover a noisy signal in the form of a combination of regressors, also called features in machine learning, themselves being the result of a learning process.The alignment of the prior covariance feature…

Statistical Mechanics · Physics 2023-01-25 Cyril Furtlehner

The automated construction of coarse-grained models represents a pivotal component in computer simulation of physical systems and is a key enabler in various analysis and design tasks related to uncertainty quantification. Pertinent methods…

Machine Learning · Statistics 2019-09-11 Constantin Grigo , Phaedon-Stelios Koutsourelakis

Data-based discovery of effective, coarse-grained (CG) models of high-dimensional dynamical systems presents a unique challenge in computational physics and particularly in the context of multiscale problems. The present paper offers a…

Computational Physics · Physics 2020-08-26 Sebastian Kaltenbach , Phaedon-Stelios Koutsourelakis

It has been observed in practice that applying pruning-at-initialization methods to neural networks and training the sparsified networks can not only retain the testing performance of the original dense models, but also sometimes even…

Machine Learning · Computer Science 2023-01-31 Hongru Yang , Yingbin Liang , Xiaojie Guo , Lingfei Wu , Zhangyang Wang

Stochastic modelling of complex systems plays an essential, yet often computationally intensive role across the quantitative sciences. Recent advances in quantum information processing have elucidated the potential for quantum simulators to…

Quantum Physics · Physics 2021-06-22 Thomas J. Elliott

We propose a data-driven, coarse-graining formulation in the context of equilibrium statistical mechanics. In contrast to existing techniques which are based on a fine-to-coarse map, we adopt the opposite strategy by prescribing a…

Machine Learning · Statistics 2017-02-01 Markus Schöberl , Nicholas Zabaras , Phaedon-Stelios Koutsourelakis

The generalization capacity of various machine learning models exhibits different phenomena in the under- and over-parameterized regimes. In this paper, we focus on regression models such as feature regression and kernel regression and…

Machine Learning · Computer Science 2022-03-14 Björn Engquist , Kui Ren , Yunan Yang

Large scale deep learning provides a tremendous opportunity to improve the quality of content recommendation systems by employing both wider and deeper models, but this comes at great infrastructural cost and carbon footprint in modern data…

Machine Learning · Computer Science 2020-10-22 Mao Ye , Dhruv Choudhary , Jiecao Yu , Ellie Wen , Zeliang Chen , Jiyan Yang , Jongsoo Park , Qiang Liu , Arun Kejariwal

Synthetic data has gained attention for training large language models, but poor-quality data can harm performance (see, e.g., Shumailov et al. (2023); Seddik et al. (2024)). A potential solution is data pruning, which retains only…

Machine Learning · Computer Science 2024-10-14 Aymane El Firdoussi , Mohamed El Amine Seddik , Soufiane Hayou , Reda Alami , Ahmed Alzubaidi , Hakim Hacid

The excellent performance of deep neural networks is usually accompanied by a large number of parameters and computations, which have limited their usage on the resource-limited edge devices. To address this issue, abundant methods such as…

Computer Vision and Pattern Recognition · Computer Science 2023-05-23 Muzhou Yu , Linfeng Zhang , Kaisheng Ma

Labeling a classification dataset implies to define classes and associated coarse labels, that may approximate a smoother and more complicated ground truth. For example, natural images may contain multiple objects, only one of which is…

Computer Vision and Pattern Recognition · Computer Science 2022-08-09 Raphael Baena , Lucas Drumetz , Vincent Gripon

Coarse graining techniques play an essential role in accelerating molecular simulations of systems with large length and time scales. Theoretically grounded bottom-up models are appealing due to their thermodynamic consistency with the…

Computational Physics · Physics 2022-11-01 Blake R. Duschatko , Jonathan Vandermause , Nicola Molinari , Boris Kozinsky

This paper studies kernel ridge regression in high dimensions under covariate shifts and analyzes the role of importance re-weighting. We first derive the asymptotic expansion of high dimensional kernels under covariate shifts. By a…

Machine Learning · Statistics 2024-06-06 Yihang Chen , Fanghui Liu , Taiji Suzuki , Volkan Cevher

We explore a systematic approach to studying the dynamics of evolving networks at a coarse-grained, system level. We emphasize the importance of finding good observables (network properties) in terms of which coarse grained models can be…

Stochastic dynamics, such as molecular dynamics, are important in many scientific applications. However, summarizing and analyzing the results of such simulations is often challenging, due to the high dimension in which simulations are…

Dynamical Systems · Mathematics 2023-09-11 David Aristoff , Mats Johnson , Danny Perez
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