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A fast spectral-domain method is proposed to evaluate the reaction terms between the Macro Basis Functions in regular and non-regular arrays made of identical printed antennas. The presented technique first exploits the filtering…

Numerical Analysis · Mathematics 2014-11-20 Shambhu Nath Jha , Christophe Craeye

Polytopal methods provide a flexible framework for the numerical approximation of partial differential equations on general meshes. Their convergence analysis raises specific challenges due to their inherently non-conforming nature and, in…

Numerical Analysis · Mathematics 2026-05-25 Lourenço Beirão da Veiga , Daniele Antonio Di Pietro , Jérôme Droniou

High-dimensional fractional reaction-diffusion equations have numerous applications in the fields of biology, chemistry, and physics, and exhibit a range of rich phenomena. While classical algorithms have an exponential complexity in the…

Quantum Physics · Physics 2026-01-21 Dong An , Konstantina Trivisa

We consider a class of linear integral operators with impulse responses varying regularly in time or space. These operators appear in a large number of applications ranging from signal/image processing to biology. Evaluating their action on…

Numerical Analysis · Mathematics 2016-04-18 Paul Escande , Pierre Weiss

Approximate solutions of the chemical master equation and the chemical Fokker-Planck equation are an important tool in the analysis of biomolecular reaction networks. Previous studies have highlighted a number of problems with the…

Quantitative Methods · Quantitative Biology 2018-05-22 Leo Bronstein , Heinz Koeppl

Normalizing flows are a promising tool for modeling probability distributions in physical systems. While state-of-the-art flows accurately approximate distributions and energies, applications in physics additionally require smooth energies…

Machine Learning · Statistics 2021-12-01 Jonas Köhler , Andreas Krämer , Frank Noé

We present selected examples demonstrating an alternative approach to contour deformation for numerically computing loop integrals in the Minkowski regime. This method focuses on identifying singular hypersurfaces (varieties of the…

High Energy Physics - Phenomenology · Physics 2024-07-10 Stephen Jones , Anton Olsson , Thomas Stone

A modified method of functional constraints is used to construct the exact solutions of nonlinear equations of reaction-diffusion type with delay and which are associated with variable coefficients. This study considers a most generalized…

Exactly Solvable and Integrable Systems · Physics 2021-10-26 M. O. Aibinu , S. C. Thakur , S. Moyo

We extend the non-parametric framework of reaction coordinate optimization to non-equilibrium ensembles of (short) trajectories. For example, we show how, starting from such an ensemble, one can obtain an equilibrium free energy profile…

Chemical Physics · Physics 2021-02-09 Sergei V. Krivov

We develop new adaptive algorithms for variational inequalities with monotone operators, which capture many problems of interest, notably convex optimization and convex-concave saddle point problems. Our algorithms automatically adapt to…

Machine Learning · Computer Science 2021-08-30 Alina Ene , Huy L. Nguyen

Turing patterns play a fundamental role in morphogenesis and population dynamics, encoding key information about the underlying biological mechanisms. Yet, traditional inverse problems have largely relied on non-biological data such as…

Analysis of PDEs · Mathematics 2025-09-10 Yuhan Li , Hongyu Liu , Catharine W. K. Lo

The discovery of transition pathways to unravel distinct reaction mechanisms and, in general, rare events that occur in molecular systems is still a challenge. Recent advances have focused on analyzing the transition path ensemble using the…

We consider the solution of large stiff systems of ordinary differential equations with explicit exponential Runge--Kutta integrators. These problems arise from semi-discretized semi-linear parabolic partial differential equations on…

Numerical Analysis · Mathematics 2023-08-24 Kai Bergermann , Martin Stoll

In most natural sciences there is currently the insight that it is necessary to bridge gaps between different processes which can be observed on different scales. This is especially true in the field of chemical reactions where the…

Molecular Networks · Quantitative Biology 2008-03-03 L. Sbano , M. Kirkilionis

We generalize ideas in the recent literature and develop new ones in order to propose a general class of contour integral methods for linear convection-diffusion PDEs and in particular for those arising in finance. These methods aim to…

Numerical Analysis · Mathematics 2021-05-31 Nicola Guglielmi , Maria López-Fernández , Mattia Manucci

The precise control of complex reactions is critical for biological processes yet our inability to design for specific outcomes limits the development of synthetic analogues. Here, we leverage differentiable simulators to design nontrivial…

Soft Condensed Matter · Physics 2025-05-13 Ryan Krueger , Ella King , Michael Brenner

Contours are used in radiotherapy treatment planning to identify regions to be irradiated with high dose and regions to be spared. Therefore, any contouring uncertainty influences the whole treatment. Even though this is the biggest…

Medical Physics · Physics 2022-04-22 Eliana Vásquez Osorio , Jane Shortall , Jennifer Robbins , Marcel van Herk

A space-time adaptive method is presented for the reactive Euler equations describing chemically reacting gas flow where a two species model is used for the chemistry. The governing equations are discretized with a finite volume method and…

Computational Physics · Physics 2019-12-16 Olivier Roussel , Kai Schneider

Integral equation methods for the solution of partial differential equations, when coupled with suitable fast algorithms, yield geometrically flexible, asymptotically optimal and well-conditioned schemes in either interior or exterior…

Numerical Analysis · Mathematics 2015-06-05 Andreas Klöckner , Alexander Barnett , Leslie Greengard , Michael O'Neil

We compare numerically the performance of reversible and non-reversible Markov Chain Monte Carlo algorithms for high dimensional oil reservoir problems; because of the nature of the problem at hand, the target measures from which we sample…

Applications · Statistics 2019-03-19 P. Dobson , I. Fursov , G. Lord , M. Ottobre