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Estimating the rate of rare conformational changes in molecular systems is one of the goals of Molecular Dynamics simulations. In the past decades, a lot of progress has been done in data-based approaches towards this problem. In contrast,…

Chemical Physics · Physics 2024-06-24 Alexander Sikorski , Amir Niknejad , Marcus Weber , Luca Donati

Motivated by applications such as sparse PCA, in this paper we present provably-accurate one-pass algorithms for the sparse approximation of the top eigenvectors of extremely massive matrices based on a single compact linear sketch. The…

Information Theory · Computer Science 2026-05-06 Edem Boahen , Simone Brugiapaglia , Hung-Hsu Chou , Mark Iwen , Felix Krahmer

We propose a novel rank-adaptive higher-order orthogonal iteration (HOOI) algorithm to compute the truncated Tucker decomposition of higher-order tensors with a given error tolerance, and prove that the method is locally optimal and…

Numerical Analysis · Mathematics 2021-10-26 Chuanfu Xiao , Chao Yang

Recursive projection aggregation (RPA) decoding as introduced in [1] is a novel decoding algorithm which performs close to the maximum likelihood decoder for short-length Reed-Muller codes. Recently, an extension to RPA decoding, called…

Information Theory · Computer Science 2022-11-03 Johannes Voigt , Holger Jäkel , Laurent Schmalen

This work, for the first time, introduces two constant factor approximation algorithms with linear query complexity for non-monotone submodular maximization over a ground set of size $n$ subject to a knapsack constraint, $\mathsf{DLA}$ and…

Data Structures and Algorithms · Computer Science 2023-07-11 Canh V. Pham , Tan D. Tran , Dung T. K. Ha , My T. Thai

In this paper, we introduce and analyze a new low-rank multilevel strategy for the solution of random diffusion problems. Using a standard stochastic collocation scheme, we first approximate the infinite dimensional random problem by a…

Numerical Analysis · Mathematics 2016-06-20 Jonas Ballani , Daniel Kressner , Michael Peters

Iterative phase retrieval algorithms typically employ projections onto constraint subspaces to recover the unknown phases in the Fourier transform of an image, or, in the case of x-ray crystallography, the electron density of a molecule.…

Numerical Analysis · Mathematics 2025-10-20 Veit Elser

The Random Phase Approximation (RPA) is a widely employed post Hartree-Fock or DFT method, capable of capturing van der Waal interactions and other dynamic correlation effects at relatively low costs of $\mathcal O(N^3)$ in time and…

Materials Science · Physics 2015-09-02 Felix Hummel

Tensor Robust Principal Component Analysis (TRPCA), which aims to recover a low-rank tensor corrupted by sparse noise, has attracted much attention in many real applications. This paper develops a new Global Weighted TRPCA method (GWTRPCA),…

Machine Learning · Computer Science 2023-01-06 Libin Wang , Yulong Wang , Shiyuan Wang , Youheng Liu , Yutao Hu , Longlong Chen , Hong Chen

In this manuscript, we introduce a tensor-based approach to Non-Negative Tensor Factorization (NTF). The method entails tensor dimension reduction through the utilization of the Einstein product. To maintain the regularity and sparsity of…

Numerical Analysis · Mathematics 2024-06-18 Anas El Hachimi , Khalide Jbilou , Ahmed Ratnani

A process centric view of robust PCA (RPCA) allows its fast approximate implementation based on a special form o a deep neural network with weights shared across all layers. However, empirically this fast approximation to RPCA fails to find…

Neural and Evolutionary Computing · Computer Science 2014-12-30 Maximilian Karl , Christian Osendorfer

Parameter-Efficient Fine-Tuning (PEFT) of text-to-image models has become an increasingly popular technique with many applications. Among the various PEFT methods, Low-Rank Adaptation (LoRA) and its variants have gained significant…

Machine Learning · Computer Science 2025-08-01 Zerui Tao , Yuhta Takida , Naoki Murata , Qibin Zhao , Yuki Mitsufuji

Canonical Polyadic (CP) tensor decomposition is a fundamental technique for analyzing high-dimensional tensor data. While the Alternating Least Squares (ALS) algorithm is widely used for computing CP decomposition due to its simplicity and…

Methodology · Statistics 2025-05-30 Runshi Tang , Julien Chhor , Olga Klopp , Anru R. Zhang

We investigate the sample size requirement for exact recovery of a high order tensor of low rank from a subset of its entries. In the Tucker decomposition framework, we show that the Riemannian optimization algorithm with initial value…

Machine Learning · Statistics 2019-11-13 Jian-Feng Cai , Lizhang Miao , Yang Wang , Yin Xian

We present a simple, general technique for reducing the sample complexity of matrix and tensor decomposition algorithms applied to distributions. We use the technique to give a polynomial-time algorithm for standard ICA with sample…

Data Structures and Algorithms · Computer Science 2015-06-22 Santosh S. Vempala , Ying Xiao

The CANDECOMP/PARAFAC (CP) decomposition is a leading method for the analysis of multiway data. The standard alternating least squares algorithm for the CP decomposition (CP-ALS) involves a series of highly overdetermined linear least…

Numerical Analysis · Computer Science 2018-08-23 Casey Battaglino , Grey Ballard , Tamara G. Kolda

Randomized numerical linear algebra is proved to bridge theoretical advancements to offer scalable solutions for approximating tensor decomposition. This paper introduces fast randomized algorithms for solving the fixed Tucker-rank problem…

Numerical Analysis · Mathematics 2025-06-06 Maolin Che , Yimin Wei , Chong Wu , Hong Yan

This paper describes a new algorithm for computing a low-Tucker-rank approximation of a tensor. The method applies a randomized linear map to the tensor to obtain a sketch that captures the important directions within each mode, as well as…

Numerical Analysis · Mathematics 2021-05-04 Yiming Sun , Yang Guo , Charlene Luo , Joel Tropp , Madeleine Udell

The use of fractional differential equations is a key tool in modeling non-local phenomena. Often, an efficient scheme for solving a linear system involving the discretization of a fractional operator is evaluating the matrix function $x =…

Numerical Analysis · Mathematics 2022-08-11 Angelo A. Casulli , Leonardo Robol

The subdiffusion equations with a Caputo fractional derivative of order $\alpha \in (0,1)$ arise in a wide variety of practical problems, which is describing the transport processes, in the force-free limit, slower than Brownian diffusion.…

Numerical Analysis · Mathematics 2023-06-27 Jiankang Shi , Minghua Chen , Yubin Yan , Jianxiong Cao