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In order to characterize molecular structures we introduce configurational fingerprint vectors which are counterparts of quantities used experimentally to identify structures. The Euclidean distance between the configurational fingerprint…

We define a distance metric between partitions of a graph using machinery from optimal transport. Our metric is built from a linear assignment problem that matches partition components, with assignment cost proportional to transport…

Optimization and Control · Mathematics 2019-10-23 Tara Abrishami , Nestor Guillen , Parker Rule , Zachary Schutzman , Justin Solomon , Thomas Weighill , Si Wu

There are many cases in collider physics and elsewhere where a calibration dataset is used to predict the known physics and / or noise of a target region of phase space. This calibration dataset usually cannot be used out-of-the-box but…

High Energy Physics - Phenomenology · Physics 2022-12-14 Radha Mastandrea , Benjamin Nachman

Most measurements in particle and nuclear physics use matrix-based unfolding algorithms to correct for detector effects. In nearly all cases, the observable is defined analogously at the particle and detector level. We point out that while…

High Energy Physics - Experiment · Physics 2022-07-08 Miguel Arratia , Daniel Britzger , Owen Long , Benjamin Nachman

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…

Computational Geometry · Computer Science 2023-11-03 Daniel Kelshaw , Luca Magri

Different types of two- and three-dimensional representations of a finite metric space are studied that focus on the accurate representation of the linear order among the distances rather than their actual values. Lower and upper bounds for…

Combinatorics · Mathematics 2007-05-23 Jobst Heitzig

Inspired by the question of whether one can create a visually informative map in which distances reflect travel-times rather than physical proximity, we examine whether it is possible to construct a meaningful travel time function between…

Metric Geometry · Mathematics 2015-07-03 Kenneth Halpern

Machine Learning has attracted considerable attention throughout the past decade due to its potential to solve far-reaching tasks, such as image classification, object recognition, anomaly detection, and data forecasting. A standard…

Machine Learning · Computer Science 2022-02-09 Gustavo Henrique de Rosa , Mateus Roder , João Paulo Papa

The knowledge that data lies close to a particular submanifold of the ambient Euclidean space may be useful in a number of ways. For instance, one may want to automatically mark any point far away from the submanifold as an outlier or to…

Information geometry is a study of statistical manifolds, that is, spaces of probability distributions from a geometric perspective. Its classical information-theoretic applications relate to statistical concepts such as Fisher information,…

Information Theory · Computer Science 2023-10-09 Kumar Vijay Mishra , M. Ashok Kumar , Ting-Kam Leonard Wong

On the set of all metric measure spaces, we have two important metrics, the box metric and the observable metric, both introduced by M. Gromov. We obtain the representation of these metrics by using transport plan. In addition, we prove the…

Metric Geometry · Mathematics 2022-06-14 Hiroki Nakajima

Transport in crowded, complex environments occurs across many spatial scales. Geometric restrictions can hinder the motion of individuals and, combined with crowding between individuals, can have drastic effects on global transport…

Physics and Society · Physics 2021-08-11 Daniel B. Wilson , Francis G. Woodhouse , Matthew J. Simpson , Ruth E. Baker

Many problems in machine learning involve calculating correspondences between sets of objects, such as point clouds or images. Discrete optimal transport provides a natural and successful approach to such tasks whenever the two sets of…

Machine Learning · Statistics 2019-02-28 David Alvarez-Melis , Stefanie Jegelka , Tommi S. Jaakkola

Distance metric learning can be viewed as one of the fundamental interests in pattern recognition and machine learning, which plays a pivotal role in the performance of many learning methods. One of the effective methods in learning such a…

Machine Learning · Computer Science 2020-02-21 Mostafa Razavi Ghods , Mohammad Hossein Moattar , Yahya Forghani

There has been much work in the recent past in developing the idea of quantum geometry to characterize and understand the structure of many-particle states. For mean-field states, the quantum geometry has been defined and analysed in terms…

Strongly Correlated Electrons · Physics 2019-06-03 S. R. Hassan , Ankita Chakrabarti , R. Shankar

Metro or transit maps, are schematic representations of transit networks to facilitate effective route-finding. These maps are often advertised on a web page or pamphlet highlighting routes from source to destination stations. To visually…

Graphics · Computer Science 2022-08-31 Tobias Batik , Soeren Terziadis , Yu-Shuen Wang , Martin Nöllenburg , Hsiang-Yun Wu

Geodesic distance serves as a reliable means of measuring distance in nonlinear spaces, and such nonlinear manifolds are prevalent in the current multimodal learning. In these scenarios, some samples may exhibit high similarity, yet they…

Computer Vision and Pattern Recognition · Computer Science 2025-05-19 Shibin Mei , Hang Wang , Bingbing Ni

Quantifying differences between flow fields is a key challenge in fluid mechanics, particularly when evaluating the effectiveness of flow control. Traditional vector metrics, such as the Euclidean distance, provide straightforward pointwise…

Fluid Dynamics · Physics 2025-11-12 Jonathan Quang Tran , Chi-An Yeh , Kunihiko Taira

Manifold optimization is ubiquitous in computational and applied mathematics, statistics, engineering, machine learning, physics, chemistry and etc. One of the main challenges usually is the non-convexity of the manifold constraints. By…

Optimization and Control · Mathematics 2019-06-14 Jiang Hu , Xin Liu , Zaiwen Wen , Yaxiang Yuan

The computation of the Minimum Orbital Intersection Distance (MOID) is an old, but increasingly relevant problem. Fast and precise methods for MOID computation are needed to select potentially hazardous asteroids from a large catalogue. The…

Earth and Planetary Astrophysics · Physics 2018-06-22 Jose M. Hedo , Manuel Ruiz , Jesus Pelaez