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In this tutorial-style review we discuss basic concepts of coupled cluster theory and recent developments that increase its computational efficiency for calculations of molecules, solids and materials in general. We will touch upon the…

Materials Science · Physics 2020-04-15 Igor Ying Zhang , Andreas Grüneis

Semi-supervised clustering is a basic problem in various applications. Most existing methods require knowledge of the ideal cluster number, which is often difficult to obtain in practice. Besides, satisfying the must-link constraints is…

Optimization and Control · Mathematics 2025-03-07 Wei Liu , Xin Liu , Michael K. Ng , Zaikun Zhang

In this paper, we investigate the use of an unsupervised label clustering technique and demonstrate that it enables substantial improvements in visual relationship prediction accuracy on the Person in Context (PIC) dataset. We propose to…

Computer Vision and Pattern Recognition · Computer Science 2018-09-11 Hsuan-Kung Yang , An-Chieh Cheng , Kuan-Wei Ho , Tsu-Jui Fu , Chun-Yi Lee

Fair clustering is a constrained variant of clustering where the goal is to partition a set of colored points, such that the fraction of points of any color in every cluster is more or less equal to the fraction of points of this color in…

Data Structures and Algorithms · Computer Science 2020-07-21 Sayan Bandyapadhyay , Fedor V. Fomin , Kirill Simonov

Automatic image clustering is a cornerstone of computer vision, yet its application to image enhancement remains limited, primarily due to the difficulty of defining clusters that are meaningful for this specific task. To address this…

Computer Vision and Pattern Recognition · Computer Science 2025-09-09 Giulia Bonino , Luca Alberto Rizzo

Correlation Clustering is an elegant model that captures fundamental graph cut problems such as Min $s-t$ Cut, Multiway Cut, and Multicut, extensively studied in combinatorial optimization. Here, we are given a graph with edges labeled $+$…

Data Structures and Algorithms · Computer Science 2017-04-04 Moses Charikar , Neha Gupta , Roy Schwartz

In machine learning, correlation clustering is an important problem whose goal is to partition the individuals into groups that correlate with their pairwise similarities as much as possible. In this work, we revisit the correlation…

Machine Learning · Computer Science 2022-02-23 Daogao Liu

With the recent popularity of graphical clustering methods, there has been an increased focus on the information between samples. We show how learning cluster structure using edge features naturally and simultaneously determines the most…

Machine Learning · Statistics 2016-05-09 Matt Barnes , Artur Dubrawski

Measuring similarity between two objects is the core operation in existing clustering algorithms in grouping similar objects into clusters. This paper introduces a new similarity measure called point-set kernel which computes the similarity…

Machine Learning · Computer Science 2022-01-07 Kai Ming Ting , Jonathan R. Wells , Ye Zhu

We consider the problem of clustering misaligned curves. According to our similarity measure, two curves are considered similar if they have the same shape after being aligned, and the warping function does not differ from the identity…

Methodology · Statistics 2018-01-03 Yu-Hsiang Cheng , Tzee-Ming Huang , Su-Fen Yang

Image segmentation aims at identifying regions of interest within an image, by grouping pixels according to their properties. This task resembles the statistical one of clustering, yet many standard clustering methods fail to meet the basic…

Computer Vision and Pattern Recognition · Computer Science 2021-01-22 Giovanna Menardi

Clustering is a widely used unsupervised learning method for finding structure in the data. However, the resulting clusters are typically presented without any guarantees on their robustness; slightly changing the used data sample or…

Machine Learning · Statistics 2017-01-02 Andreas Henelius , Kai Puolamäki , Henrik Boström , Panagiotis Papapetrou

In this work, the possibility of clustering correlated random variables was examined, both because of their mutual similarity and because of their similarity to the principal components. The k-means algorithm and spectral algorithms were…

Machine Learning · Computer Science 2019-09-10 Zenon Gniazdowski , Dawid Kaliszewski

Clustering is a NP-hard problem. Thus, no optimal algorithm exists, heuristics are applied to cluster the data. Heuristics can be very resource-intensive, if not applied properly. For substantially large data sets computational efficiencies…

Databases · Computer Science 2020-03-11 Mujahid Sultan

Correlation clustering is a well-studied problem, first proposed by Bansal, Blum, and Chawla [Mach. Learn. '04]. The input is an unweighted, undirected graph. The problem is to cluster the vertices so as to minimize the number of edges…

Data Structures and Algorithms · Computer Science 2026-05-12 Nairen Cao , Vincent Cohen-Addad , Euiwoong Lee , Shi Li , David Rasmussen Lolck , Alantha Newman , Mikkel Thorup , Lukas Vogl , Shuyi Yan , Hanwen Zhang

Clustering algorithms are one of the main analytical methods to detect patterns in unlabeled data. Existing clustering methods typically treat samples in a dataset as points in a metric space and compute distances to group together similar…

Machine Learning · Computer Science 2021-10-12 Tarek Naous , Srinjay Sarkar , Abubakar Abid , James Zou

In this paper a variant of the classical hierarchical cluster analysis is reported. This agglomerative (bottom-up) cluster technique is referred to as the Adaptive Mean-Linkage Algorithm. It can be interpreted as a linkage algorithm where…

Methodology · Statistics 2015-02-10 H. M. de Oliveira

The cluster analysis of very large objects is an important problem, which spans several theoretical as well as applied branches of mathematics and computer science. Here we suggest a novel approach: under assumption of local convergence of…

Combinatorics · Mathematics 2015-10-28 Jaroslav Nesetril , Patrice Ossona de Mendez

Spectral clustering is one of the most prominent clustering approaches. The distance-based similarity is the most widely used method for spectral clustering. However, people have already noticed that this is not suitable for multi-scale…

Machine Learning · Computer Science 2020-09-11 Hengrui Wang , Yubo Zhang , Mingzhi Chen , Tong Yang

Cluster matching by permuting cluster labels is important in many clustering contexts such as cluster validation and cluster ensemble techniques. The classic approach is to minimize the euclidean distance between two cluster solutions which…

Artificial Intelligence · Computer Science 2007-05-31 Jens Oehlschlägel