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This paper presents a new distance geometry algorithm for calculating atomic coordinates from estimates of the interatomic distances, which maintains the positions of the atoms in a known rigid substructure. Given an $M \times 3$ matrix of…

数值分析 · 计算机科学 2018-05-01 Igor Najfeld , Timothy F. Havel

Domain specific (dis-)similarity or proximity measures used e.g. in alignment algorithms of sequence data, are popular to analyze complex data objects and to cover domain specific data properties. Without an underlying vector space these…

数据结构与算法 · 计算机科学 2014-11-07 Andrej Gisbrecht , Frank-Michael Schleif

We study low-rank matrix regression in settings where matrix-valued predictors and scalar responses are observed across multiple individuals. Rather than assuming a fully homogeneous coefficient matrices across individuals, we accommodate…

统计方法学 · 统计学 2025-10-28 Di Wang , Xiaoyu Zhang , Guodong Li , Wenyang Zhang

This paper deals with the reconstruction of a discrete measure $\gamma_Z$ on $\mathbb{R}^d$ from the knowledge of its pushforward measures $P_i\#\gamma_Z$ by linear applications $P_i: \mathbb{R}^d \rightarrow \mathbb{R}^{d_i}$ (for instance…

概率论 · 数学 2025-08-20 Eloi Tanguy , Rémi Flamary , Julie Delon

The distance matrix of a dataset $X$ of $n$ points with respect to a distance function $f$ represents all pairwise distances between points in $X$ induced by $f$. Due to their wide applicability, distance matrices and related families of…

数据结构与算法 · 计算机科学 2022-10-28 Piotr Indyk , Sandeep Silwal

The accurate detection of small deviations in given density matrices is important for quantum information processing. Here we propose a new method based on the concept of data mining. We demonstrate that the proposed method can more…

量子物理 · 物理学 2015-06-18 Satoshi Hara , Takafumi Ono , Ryo Okamoto , Takashi Washio , Shigeki Takeuchi

With the emergence of Artificial Intelligence, numerical algorithms are moving towards more approximate approaches. For methods such as PCA or diffusion maps, it is necessary to compute eigenvalues of a large matrix, which may also be dense…

数值分析 · 数学 2023-11-17 Keerthi Gaddameedi , Severin Reiz , Tobias Neckel , Hans-Joachim Bungartz

Pseudospectral analysis is fundamental for quantifying the sensitivity and transient behavior of nonnormal matrices, yet its computational cost scales cubically with dimension, rendering it prohibitive for large-scale systems. While…

数值分析 · 数学 2026-02-03 Vladimir R. Kostic , Dragana Lj. Cvetkovic , Ljiljana Cvetkovic

Manifolds discovered by machine learning models provide a compact representation of the underlying data. Geodesics on these manifolds define locally length-minimising curves and provide a notion of distance, which are key for reduced-order…

机器学习 · 计算机科学 2023-05-25 Daniel Kelshaw , Luca Magri

A Euclidean distance matrix $D(\alpha)$ is defined by $D_{ij}=(\alpha_i-\alpha_j)^2$, where $\alpha=(\alpha_1,\ldots,\alpha_n)$ is a real vector. We prove that $D(\alpha)$ cannot be written as a sum of $\left[2\sqrt{n}-2\right]$ nonnegative…

组合数学 · 数学 2016-07-28 Yaroslav Shitov

Large-scale eigenvalue problems pose a significant challenge to classical computers. While there are efficient quantum algorithms for unitary or Hermitian matrices, eigenvalue problems for non-normal matrices remain open in quantum…

量子物理 · 物理学 2026-03-25 Honghong Lin , Yun Shang

We study the differential structure of the set of real logarithms of a non-singular real matrix, under the assumption that the matrix is either semi-simple or orthogonal.

微分几何 · 数学 2022-09-14 Donato Pertici

A distance measure is presented between two unitary propagators of quantum systems of differing dimensions along with a corresponding method of computation. A typical application is to compare the propagator of the actual (real) process…

量子物理 · 物理学 2007-05-23 Robert L. Kosut , Matthew Grace , Constantin Brif , Herschel Rabitz

We consider the problem of finding nonzero eigenvalues and the corresponding eigenvectors of a matrix $AA^{\top}$, where $A$ is a special incidence matrix; This matrix can equivalently be defined based on a match relation between some…

组合数学 · 数学 2016-05-24 M. Mohammad-Noori , N. Ghareghani , M. Ghandi

A generalization of the Wasserstein metric, the integrated transportation distance, establishes a novel distance between probability kernels of Markov systems. This metric serves as the foundation for an efficient approximation technique,…

机器学习 · 计算机科学 2023-12-07 Zhengqi Lin , Andrzej Ruszczynski

Consider an $n\times n$ matrix polynomial $P(\lambda)$ and a set $\Sigma$ consisting of $k \le n$ distinct complex numbers. In this paper, a (weighted) spectral norm distance from $P(\lambda)$ to the matrix polynomials whose spectra include…

数值分析 · 数学 2015-05-26 E. Kokabifar , G. B. Loghmani , P. J. Psarrakos , S. M. Karbassi

We study the problem of finding, in a real algebraic matrix group, the matrix closest to a given data matrix. We do so from the algebro-geometric perspective of Euclidean distance degrees. We recover several classical results; and among the…

最优化与控制 · 数学 2017-10-10 Jasmijn A. Baaijens , Jan Draisma

We present an algorithm to compute the Jordan chain of a nearly defective matrix with a $2\times2$ Jordan block. The algorithm is based on an inverse-iteration procedure and only needs information about the invariant subspace corresponding…

数值分析 · 数学 2017-04-25 Felipe Hernández , Adi Pick , Steven G. Johnson

This paper is on the normal approximation of singular subspaces when the noise matrix has i.i.d. entries. Our contributions are three-fold. First, we derive an explicit representation formula of the empirical spectral projectors. The…

统计理论 · 数学 2019-07-29 Dong Xia

The pseudospectrum of a linear time-invariant system is the set in the complex plane consisting of all the roots of the characteristic equation when the system matrices are subjected to all possible perturbations with a given upper bound.…

系统与控制 · 电气工程与系统科学 2020-03-19 Suat Gumussoy , Wim Michiels