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In the number partitioning problem (NPP) one aims to partition a given set of $N$ real numbers into two subsets with approximately equal sum. The NPP is a well-studied optimization problem and is famous for possessing a…

Statistics Theory · Mathematics 2025-05-28 Rushil Mallarapu , Mark Sellke

In many robotics applications, it is necessary to compute not only the distance between the robot and the environment, but also its derivative - for example, when using control barrier functions. However, since the traditional Euclidean…

We study a fundamental problem in computational chemistry known as molecular conformation generation, trying to predict stable 3D structures from 2D molecular graphs. Existing machine learning approaches usually first predict distances…

Machine Learning · Computer Science 2021-06-09 Chence Shi , Shitong Luo , Minkai Xu , Jian Tang

How do the geometric properties of a domain impact the spectrum of an operator defined on it? How do we compute accurate and reliable approximations of these spectra? The former question is studied in spectral geometry, and the latter is a…

Numerical Analysis · Mathematics 2026-01-01 Nilima Nigam

Gradient Descent (GD) and Conjugate Gradient (CG) methods are among the most effective iterative algorithms for solving unconstrained optimization problems, particularly in machine learning and statistical modeling, where they are employed…

Optimization and Control · Mathematics 2024-12-19 Xianqi Jiao , Jia Liu , Zhiping Chen

Geodesic problems involve computing trajectories between prescribed initial and final states to minimize a user-defined measure of distance, cost, or energy. They arise throughout physics and engineering -- for instance, in determining…

Machine Learning · Computer Science 2025-11-06 Conor Rowan

In the domain of geometry and topology optimization, discovering geometries that optimally satisfy specific problem criteria is a complex challenge in both engineering and scientific research. In this work, we propose a new approach for the…

Computational Physics · Physics 2024-11-26 Alexander Luce , Daniel Grünbaum , Florian Marquardt

We consider the problem of learning a linear subspace from data corrupted by outliers. Classical approaches are typically designed for the case in which the subspace dimension is small relative to the ambient dimension. Our approach works…

Computer Vision and Pattern Recognition · Computer Science 2019-11-11 Manolis C. Tsakiris , Rene Vidal

We study the convergence of the new family of mimetic finite difference schemes for linear diffusion problems recently proposed in [38]. In contrast to the conventional approach, the diffusion coefficient enters both the primary mimetic…

Numerical Analysis · Mathematics 2016-12-07 G. Manzini , K. Lipnikov , J. D. Moulton , M. Shashkov

We propose an iterative method for nonlinear semidefinite programs with box constraints. The search direction in the proposed method utilizes the distance from the current point to the boundary of a feasible set. The computation of the…

Optimization and Control · Mathematics 2015-05-15 Akihiko Komatsu , Makoto Yamashita

Direct methods for the simulation of optimal control problems apply a specific discretization to the dynamics of the problem, and the discrete adjoint method is suitable to calculate corresponding conditions to approximate an optimal…

Approximate dynamic programming is a popular method for solving large Markov decision processes. This paper describes a new class of approximate dynamic programming (ADP) methods- distributionally robust ADP-that address the curse of…

Machine Learning · Statistics 2012-05-22 Marek Petrik

Fixed-Point-Oriented Programming (FPOP) is an emerging paradigm designed to streamline the implementation of problems involving self-referential computations. These include graph algorithms, static analysis, parsing, and distributed…

Programming Languages · Computer Science 2025-07-30 Yong Qi Foo , Brian Sze-Kai Cheong , Michael D. Adams

Molecular structure has important applications in many fields. For example, some studies show that molecular spatial information can be used to achieve better prediction results when predicting molecular properties. However, traditional…

Chemical Physics · Physics 2022-03-14 Xiaohui Lin , Yongquan Jiang , Yan Yang

This paper introduces Chance Constrained Gaussian Process-Motion Planning (CCGP-MP), a motion planning algorithm for robotic systems under motion and state estimate uncertainties. The paper's key idea is to capture the variations in the…

Robotics · Computer Science 2021-07-26 Jacob J. Johnson , Michael C. Yip

In this paper we propose a dynamic programming solution to the template-based recognition task in OCR case. We formulate a problem of optimal position search for complex objects consisting of parts forming a sequence. We limit the distance…

Computer Vision and Pattern Recognition · Computer Science 2020-08-03 M. A. Povolotskiy , D. V. Tropin

We present a geometric formulation of the Multiple Kernel Learning (MKL) problem. To do so, we reinterpret the problem of learning kernel weights as searching for a kernel that maximizes the minimum (kernel) distance between two convex…

Machine Learning · Computer Science 2014-03-18 John Moeller , Parasaran Raman , Avishek Saha , Suresh Venkatasubramanian

In the constraint programming framework, state-of-the-art static and dynamic decomposition techniques are hard to apply to problems with complete initial constraint graphs. For such problems, we propose a hybrid approach of these techniques…

Computational Complexity · Computer Science 2008-12-18 Stephane Zampelli , Martin Mann , Yves Deville , Rolf Backofen

Spectral clustering and its extensions usually consist of two steps: (1) constructing a graph and computing the relaxed solution; (2) discretizing relaxed solutions. Although the former has been extensively investigated, the discretization…

Machine Learning · Computer Science 2023-10-20 Hongyuan Zhang , Xuelong Li

Many combinatorial optimization problems can be formulated as the search for a subgraph that satisfies certain properties and minimizes the total weight. We assume here that the vertices correspond to points in a metric space and can take…

Data Structures and Algorithms · Computer Science 2024-12-25 Marin Bougeret , Jérémy Omer , Michael Poss
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