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Simulated annealing - moving from a tractable distribution to a distribution of interest via a sequence of intermediate distributions - has traditionally been used as an inexact method of handling isolated modes in Markov chain samplers.…

Computational Physics · Physics 2007-05-23 Radford M. Neal

In this paper, we introduce a neural network framework for semi-supervised clustering (SSC) with pairwise (must-link or cannot-link) constraints. In contrast to existing approaches, we decompose SSC into two simpler classification…

Machine Learning · Computer Science 2020-01-22 Marek Śmieja , Łukasz Struski , Mário A. T. Figueiredo

Several stochastic simulation algorithms (SSAs) have been recently proposed for modelling reaction-diffusion processes in cellular and molecular biology. In this paper, two commonly used SSAs are studied. The first SSA is an on-lattice…

Biological Physics · Physics 2015-05-13 Radek Erban , S Jonathan Chapman

Image-based crack detection algorithms are increasingly in demand in infrastructure monitoring, as early detection of cracks is of paramount importance for timely maintenance planning. While deep learning has significantly advanced crack…

Computer Vision and Pattern Recognition · Computer Science 2025-04-22 Ghodsiyeh Rostami , Po-Han Chen , Mahdi S. Hosseini

We adapt the simulated annealing algorithm to the search of periodic orbits for classical multi-electron atomic systems. This is done by minimizing the n-th return distance to the initial position on a Poincare surface of section under an…

Atomic Physics · Physics 2011-02-17 Francois Mauger , Cristel Chandre , Turgay Uzer

Principal component analysis (PCA), the most popular dimension-reduction technique, has been used to analyze high-dimensional data in many areas. It discovers the homogeneity within the data and creates a reduced feature space to capture as…

Methodology · Statistics 2026-03-24 Daning Bi , Le Chang , Yanrong Yang

Clustering is a fundamental unsupervised representation learning task with wide application in computer vision and pattern recognition. Deep clustering utilizes deep neural networks to learn latent representation, which is suitable for…

Computer Vision and Pattern Recognition · Computer Science 2023-12-27 Wenhao Wu , Weiwei Wang , Shengjiang Kong

With rapidly increasing data, clustering algorithms are important tools for data analytics in modern research. They have been successfully applied to a wide range of domains; for instance, bioinformatics, speech recognition, and financial…

Data Structures and Algorithms · Computer Science 2015-12-01 Ka-Chun Wong

Principal Component Analysis (PCA) is the most widely used tool for linear dimensionality reduction and clustering. Still it is highly sensitive to outliers and does not scale well with respect to the number of data samples. Robust PCA…

Computer Vision and Pattern Recognition · Computer Science 2015-04-24 Nauman Shahid , Vassilis Kalofolias , Xavier Bresson , Michael Bronstein , Pierre Vandergheynst

The anticlustering problem is to partition a set of objects into K equal-sized anticlusters such that the sum of distances within anticlusters is maximized. The anticlustering problem is NP-hard. We focus on anticlustering in Euclidean…

Machine Learning · Computer Science 2026-01-13 Philipp Baumann , Olivier Goldschmidt , Dorit S. Hochbaum , Jason Yang

The alignment of biological networks has the potential to teach us as much about biology and disease as has sequence alignment. Sequence alignment can be optimally solved in polynomial time. In contrast, network alignment is $NP$-hard,…

Molecular Networks · Quantitative Biology 2016-07-12 Nil Mamano , Wayne Hayes

Solving systems of Boolean equations is a fundamental task in symbolic computation and algebraic cryptanalysis, with wide-ranging applications in cryptography, coding theory, and formal verification. Among existing approaches, the Boolean…

Cryptography and Security · Computer Science 2026-04-21 Minzhong Luo , Yudong Sun , Yin Long

A new approach to combinatorial optimization based on systematic move-class deflation is proposed. The algorithm combines heuristics of genetic algorithms and simulated annealing, and is mainly entropy-driven. It is tested on two problems…

Statistical Mechanics · Physics 2007-05-23 Reimer Kuehn , Yu-Cheng Lin , Gerhard Poeppel

Simulated Annealing (SA) is a widely used stochastic optimization algorithm, yet much of its theoretical understanding is limited to asymptotic convergence guarantees or general spectral bounds. In this paper, we develop a finite-time…

Systems and Control · Electrical Eng. & Systems 2026-02-11 Hansini Ramachandran , Bhaskar Krishnamachari

We propose a simulated annealing algorithm (called SNICA for "stochastic non-negative independent component analysis") for blind decomposition of linear mixtures of non-negative sources with non-negative coefficients. The de-mixing is based…

Chemical Physics · Physics 2011-11-09 Sergey A. Astakhov , Harald Stögbauer , Alexander Kraskov , Peter Grassberger

The quadratic assignment problem (QAP) is one of the most difficult combinatorial optimization problems. One of the most powerful and commonly used heuristics to obtain approximations to the optimal solution of the QAP is simulated…

Neural and Evolutionary Computing · Computer Science 2011-11-08 Gerald Paul

Subspace clustering (SC) is a promising clustering technology to identify clusters based on their associations with subspaces in high dimensional spaces. SC can be classified into hard subspace clustering (HSC) and soft subspace clustering…

Machine Learning · Computer Science 2016-04-11 Zhaohong Deng , Kup-Sze Choi , Yizhang Jiang , Jun Wang , Shitong Wang

The floorplanning of Systems-on-a-Chip (SoCs) and of chip sub-systems is a crucial step in the physical design flow as it determines the optimal shapes and locations of the blocks that make up the system. Simulated Annealing (SA) has been…

Other Computer Science · Computer Science 2024-08-05 Hesham Mostafa , Uday Mallappa , Mikhail Galkin , Mariano Phielipp , Somdeb Majumdar

We investigate the potential of numerical algorithms to decipher the kinetic parameters involved in multi-step chemical reactions. To this end we study a dimerization kinetics of protein as a model system. We follow the dimerization…

Biological Physics · Physics 2014-12-24 Srijeeta Talukder , Shrabani Sen , Ralf Metzler , Suman K Banik , Pinaki Chaudhury

Principal component analysis (PCA) is a widely used dimension reduction technique in machine learning and multivariate statistics. To improve the interpretability of PCA, various approaches to obtain sparse principal direction loadings have…

Data Structures and Algorithms · Computer Science 2021-06-07 Agniva Chowdhury , Petros Drineas , David P. Woodruff , Samson Zhou
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