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Understanding the dynamics of complex molecular processes is often linked to the study of infrequent transitions between long-lived stable states. The standard approach to the sampling of such rare events is to generate an ensemble of…

Computational Physics · Physics 2023-05-22 Sebastian Falkner , Alessandro Coretti , Salvatore Romano , Phillip Geissler , Christoph Dellago

Disentangling and recovering physical attributes, such as shape and material, from a few waveform examples is a challenging inverse problem in audio signal processing, with numerous applications in musical acoustics as well as structural…

Sound · Computer Science 2020-07-21 Han Han , Vincent Lostanlen

With the increasing computational power of current supercomputers, the size of data produced by scientific simulations is rapidly growing. To reduce the storage footprint and facilitate scalable post-hoc analyses of such scientific data…

Machine Learning · Computer Science 2021-04-14 Subhashis Hazarika , Ayan Biswas , Phillip J. Wolfram , Earl Lawrence , Nathan Urban

Diffusion models have become emerging generative models. Their sampling process involves multiple steps, and in each step the models predict the noise from a noisy sample. When the models make prediction, the output deviates from the ground…

Machine Learning · Computer Science 2025-10-28 Shifeng Xu , Yanzhu Liu , Adams Wai-Kin Kong

We address the problem of designing micro-fluidic chips for sample preparation, which is a crucial step in many experimental processes in chemical and biological sciences. One of the objectives of sample preparation is to dilute the sample…

Data Structures and Algorithms · Computer Science 2019-11-07 Miguel Coviello Gonzalez , Marek Chrobak

Estimating density ratios between pairs of intractable data distributions is a core problem in probabilistic modeling, enabling principled comparisons of sample likelihoods under different data-generating processes across conditions and…

Machine Learning · Computer Science 2026-03-02 Egor Antipov , Alessandro Palma , Lorenzo Consoli , Stephan Günnemann , Andrea Dittadi , Fabian J. Theis

A method for estimating the relative content of crystalline phases of a multiphase sample, based on probabilistic analysis of the intensities of the diffraction pattern reflexes, has been developed. The method is based on the introduction…

Materials Science · Physics 2023-11-21 S. V. Gabielkov , I. V. Zhyganiuk , A. D. Skorbun

Machine learning for the parameterization of subgrid-scale processes in climate models has been widely researched and adopted in a few models. A key challenge in developing data-driven parameterization schemes is how to properly represent…

Atmospheric and Oceanic Physics · Physics 2024-02-29 L. Minah Yang , Edwin P. Gerber

Flow cytometry mainly used for detecting the characteristics of a number of biochemical substances based on the expression of specific markers in cells. It is particularly useful for detecting membrane surface receptors, antigens, ions, or…

Machine Learning · Computer Science 2023-03-17 Yanhua Xu

Sampling from unnormalized target distributions is a fundamental yet challenging task in machine learning and statistics. Existing sampling algorithms typically require many iterative steps to produce high-quality samples, leading to high…

Machine Learning · Statistics 2026-02-27 Pascal Jutras-Dube , Jiaru Zhang , Ziran Wang , Ruqi Zhang

Sampling from unnormalized target distributions is a fundamental yet challenging task in machine learning and statistics. Existing sampling algorithms typically require many iterative steps to produce high-quality samples, leading to high…

Machine Learning · Computer Science 2025-02-17 Pascal Jutras-Dubé , Patrick Pynadath , Ruqi Zhang

The use of low-cost sensors in conjunction with high-precision instrumentation for air pollution monitoring has shown promising results in recent years. One of the main challenges for these sensors has been the quality of their data, which…

Signal Processing · Electrical Eng. & Systems 2022-06-03 Pau Ferrer-Cid , Julio Garcia-Calvete , Aina Main-Nadal , Zhe Ye , Jose M. Barcelo-Ordinas , Jorge Garcia-Vidal

Diffusion models have recently emerged as the dominant approach in visual generation tasks. However, the lengthy denoising chains and the computationally intensive noise estimation networks hinder their applicability in low-latency and…

Computer Vision and Pattern Recognition · Computer Science 2026-04-23 Qian Zeng , Jie Song , Yuanyu Wan , Huiqiong Wang , Mingli Song

In recent years, Rectified flow (RF) has gained considerable popularity largely due to its generation efficiency and state-of-the-art performance. In this paper, we investigate the degree to which RF automatically adapts to the intrinsic…

Machine Learning · Statistics 2026-02-24 Saptarshi Roy , Alessandro Rinaldo , Purnamrita Sarkar

Dataset distillation aims to synthesize small datasets with little information loss from original large-scale ones for reducing storage and training costs. Recent state-of-the-art methods mainly constrain the sample synthesis process by…

Computer Vision and Pattern Recognition · Computer Science 2023-08-31 Yanqing Liu , Jianyang Gu , Kai Wang , Zheng Zhu , Wei Jiang , Yang You

We introduce a temporal scheme for data sampling, based on a variable delay between two successive data acquisitions. The scheme is designed so as to reduce the average data flow rate, while still retaining the information on the data…

Soft Condensed Matter · Physics 2016-08-06 A. Philippe , S. Aime , V. Roger , R. Jelinek , G. Prévot , L. Berthier , L. Cipelletti

Estimating composition dependent diffusion coefficients in multicomponent alloys was a longstanding challenge due to limitations in experimental methods. In this study, we have first demonstrated a strategic design of producing only three…

Materials Science · Physics 2025-06-17 Suman Sadhu , Saswata Bhattacharyya , Aloke Paul

Discovering heterogeneous catalysts tailored for specific reaction intermediates remains a fundamental bottleneck in materials science. While traditional trial-and-error methods and recent generative models have shown promise, they struggle…

Materials Science · Physics 2026-05-19 Minkyu Kim , Nayoung Kim , Honghui Kim , Sungsoo Ahn

In this paper we show how to use data on Lyman-limit and Damped Lyman-alpha absorption systems to derive the hydrogen ionization fractions and the distribution of the face-on total gas column density. We consider axially symmetric, randomly…

Astrophysics · Physics 2009-11-06 Rino Bandiera , Edvige Corbelli

Heat diffusion processes have found wide applications in modelling dynamical systems over graphs. In this paper, we consider the recovery of a $k$-bandlimited graph signal that is an initial signal of a heat diffusion process from its…

Information Theory · Computer Science 2021-10-05 Longxiu Huang , Deanna Needell , Sui Tang