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Modeling non-empirical and highly flexible interatomic potential energy surfaces (PES) using machine learning (ML) approaches is becoming popular in molecular and materials research. Training an ML-PES is typically performed in two stages:…

材料科学 · 物理学 2021-01-05 Suresh Kondati Natarajan , Miguel A. Caro

Tracking progress in machine learning has become increasingly difficult with the recent explosion in the number of papers. In this paper, we present AxCell, an automatic machine learning pipeline for extracting results from papers. AxCell…

计算与语言 · 计算机科学 2020-04-30 Marcin Kardas , Piotr Czapla , Pontus Stenetorp , Sebastian Ruder , Sebastian Riedel , Ross Taylor , Robert Stojnic

Emissive organic radicals are currently of great interest for their potential use in the next generation of highly efficient organic light emitting diode (OLED) devices and as molecular qubits. However, simulating their optoelectronic…

Sparse tensor computing is a core computational part of numerous applications in areas such as data science, graph processing, and scientific computing. Sparse tensors offer the potential of skipping unnecessary computations caused by zero…

硬件体系结构 · 计算机科学 2023-03-28 Midia Reshadi , David Gregg

In this paper, we study the efficacy and utility of recent advances in non-local, non-linear image interpolation and extrapolation algorithms, specifically, ideas based on Implicit Neural Representations (INR), as a tool for analysis of…

基因组学 · 定量生物学 2025-06-16 Xizheng Yu , Justin Torok , Sneha Pandya , Sourav Pal , Vikas Singh , Ashish Raj

Context. Observations of many active regions show a slow systematic outflow/upflow from their edges lasting from hours to days. At present no physical explanation has been proven, while several suggestions have been put forward. Aims. This…

太阳与恒星天体物理 · 物理学 2021-08-25 K. Galsgaard , M. S. Madjarska , K. Vanninathan , Z. Huang , M. Presmann

We develop and implement in this paper a fast sparse assembly algorithm, the fundamental operation which creates a compressed matrix from raw index data. Since it is often a quite demanding and sometimes critical operation, it is of…

分布式、并行与集群计算 · 计算机科学 2016-04-28 Stefan Engblom , Dimitar Lukarski

In this work we develop a dynamically adaptive sparse grids (SG) method for quasi-optimal interpolation of multidimensional analytic functions defined over a product of one dimensional bounded domains. The goal of such approach is to…

数值分析 · 数学 2015-08-06 Miroslav K. Stoyanov , Clayton G. Webster

Layout hotpot detection is one of the main steps in modern VLSI design. A typical hotspot detection flow is extremely time consuming due to the computationally expensive mask optimization and lithographic simulation. Recent researches try…

机器学习 · 计算机科学 2018-07-18 Haoyu Yang , Shuhe Li , Cyrus Tabery , Bingqing Lin , Bei Yu

This paper investigates and evaluates support vector machine active learning algorithms for use with imbalanced datasets, which commonly arise in many applications such as information extraction applications. Algorithms based on…

机器学习 · 计算机科学 2018-05-18 Michael Bloodgood

Expanding laser plasmas, produced by high energy laser radiation, possess both high thermal and magnetic field energy density. Characterization of such plasma is challenging but needed for understanding of its physical behaviour. Among all…

3D pose estimation from sparse multi-views is a critical task for numerous applications, including action recognition, sports analysis, and human-robot interaction. Optimization-based methods typically follow a two-stage pipeline, first…

计算机视觉与模式识别 · 计算机科学 2026-01-15 Tony Danjun Wang , Tolga Birdal , Nassir Navab , Lennart Bastian

This is a methodological guide to the use of deep neural networks in the processing of pulsed dipolar spectroscopy (PDS) data encountered in structural biology, organic photovoltaics, photosynthesis research, and other domains featuring…

Deep learning models for medical image segmentation are primarily data-driven. Models trained with more data lead to improved performance and generalizability. However, training is a computationally expensive process because multiple…

图像与视频处理 · 电气工程与系统科学 2021-07-13 Vishwesh Nath , Dong Yang , Ali Hatamizadeh , Anas A. Abidin , Andriy Myronenko , Holger Roth , Daguang Xu

Placement is an essential task in modern chip design, aiming at placing millions of circuit modules on a 2D chip canvas. Unlike the human-centric solution, which requires months of intense effort by hardware engineers to produce a layout to…

计算机视觉与模式识别 · 计算机科学 2022-11-28 Yao Lai , Yao Mu , Ping Luo

Datasets often incorporate various functional patterns related to different aspects or regimes, which are typically not equally present throughout the dataset. We propose a novel, general-purpose partitioning algorithm that utilizes…

机器学习 · 计算机科学 2025-12-02 Marius Tacke , Matthias Busch , Kevin Linka , Christian J. Cyron , Roland C. Aydin

We propose an active learning algorithm for linear system identification with optimal centered noise excitation. Notably, our algorithm, based on ordinary least squares and semidefinite programming, attains the minimal sample complexity…

最优化与控制 · 数学 2026-04-08 Kaito Ito , Alexandre Proutiere

Machine learning is starting to be used in almost every industry and academic research, and solar physics is no exception. A newly developed machine learning model named MagNet helps us to tackle some of the most serious challenges in data…

太阳与恒星天体物理 · 物理学 2026-02-27 Aryiadna Yesmanchyk , Yan Xu , Jason T. L. Wang , Haodi Jiang , Chunhui Xu , Haimin Wang

Subspace clustering methods which embrace a self-expressive model that represents each data point as a linear combination of other data points in the dataset provide powerful unsupervised learning techniques. However, when dealing with…

计算机视觉与模式识别 · 计算机科学 2023-10-06 Katsuya Hotta , Takuya Akashi , Shogo Tokai , Chao Zhang

Existing permanental processes often impose constraints on kernel types or stationarity, limiting the model's expressiveness. To overcome these limitations, we propose a novel approach utilizing the sparse spectral representation of…

机器学习 · 统计学 2024-12-20 Zicheng Sun , Yixuan Zhang , Zenan Ling , Xuhui Fan , Feng Zhou
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