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The Molecular Distance Geometry Problem (MDGP) is essential in structural biology, as it seeks to determine three-dimensional protein structures from partial interatomic distances. Its discretizable subclass (DMDGP) admits an exact…

Optimization and Control · Mathematics 2025-10-24 Leonardo D. Secchin , Wagner da Rocha , Mariana da Rosa , Leo Liberti , Carlile Lavor

In contact mechanics computation, the constraint conditions on the contact surfaces are typically enforced by the Lagrange multiplier method, resulting in a saddle point system. The mortar finite element method is usually employed to…

Numerical Analysis · Mathematics 2024-09-24 Xiaoyu Duan , Hengbin An , Zeyao Mo

Persson's theory of contact is extensively used in the study of the purely normal interaction between a nominally flat rough surface and a rigid flat. In the literature, Persson's theory was successfully applied to the elastoplastic contact…

Soft Condensed Matter · Physics 2022-08-05 Yang Xu , Xiaobao Li , Daniel M. Mulvihill

We propose a unified iterative framework for the solution of frictionless mechanical contact problems, which relies exclusively on the solution of standard stiffness systems. The framework is built upon a two-step fixed-point algorithm:…

Numerical Analysis · Mathematics 2026-03-13 Daria Koliesnikova , Isabelle Ramière

This work presents a new adaptive approach for the numerical simulation of a phase-field model for fractures in nearly incompressible solids. In order to cope with locking effects, we use a recently proposed mixed form where we have a…

Numerical Analysis · Mathematics 2021-06-18 Katrin Mang , Mirjam Walloth , Thomas Wick , Winnifried Wollner

We consider a linear algebra approach to establishing a discrete comparison principle for a nonmonotone class of quasilinear elliptic partial differential equations. In the absence of a lower order term, we require local conditions on the…

Numerical Analysis · Mathematics 2018-03-19 Sara Pollock , Yunrong Zhu

The paper is devoted to the penalty Robin-Robin domain decomposition methods (DDMs), proposed by us for the solution of unilateral multibody contact problems of elasticity. These DDMs are based on the penalty method for variational…

Numerical Analysis · Mathematics 2015-04-28 Ivan I. Dyyak , Ihor I. Prokopyshyn , Ivan A. Prokopyshyn

Removing geometrical details from a complex domain is a classical operation in computer aided design. This procedure simplifies the meshing process, and it enables faster simulations with less memory requirements. However, depending on the…

Numerical Analysis · Mathematics 2024-07-18 Annalisa Buffa , Ondine Chanon , Rafael Vázquez

This paper proposes and analyzes a dampened proximal alternating direction method of multipliers (DP.ADMM) for solving linearly-constrained nonconvex optimization problems where the smooth part of the objective function is nonseparable.…

Optimization and Control · Mathematics 2023-01-05 Weiwei Kong , Renato D. C. Monteiro

We introduce two improvements in the numerical scheme to simulate collision and slow shearing of irregular particles. First, we propose an alternative approach based on simple relations to compute the frictional contact forces. The approach…

Materials Science · Physics 2011-03-15 Andres A. Pena , Pedro G. Lind , Hans J. Herrmann

This work presents a concise theoretical and computational framework for the finite element formulation of frictional contact problems with arbitrarily large deformation and sliding. The aim of this work is to extend the contact theory…

Computational Engineering, Finance, and Science · Computer Science 2019-04-03 Thang X. Duong , Roger A. Sauer

The Poisson-Boltzmann equation is widely used to model molecular electrostatics; however, it is usually solved in linearised form because the sinh nonlinearity is challenging, limiting its applicability in highly charged systems such as…

Computational Physics · Physics 2026-04-20 Mauricio Guerrero-Montero , Michal Bosy , Christopher D. Cooper

In this article we study adaptive finite element methods (AFEM) with inexact solvers for a class of semilinear elliptic interface problems. We are particularly interested in nonlinear problems with discontinuous diffusion coefficients, such…

Numerical Analysis · Mathematics 2016-08-24 Michael Holst , Ryan Szypowski , Yunrong Zhu

We propose a new fictitious domain finite element method, well suited for elliptic problems posed in a domain given by a level-set function without requiring a mesh fitting the boundary. To impose the Dirichlet boundary conditions, we…

Numerical Analysis · Mathematics 2019-07-09 Michel Duprez , Alexei Lozinski

Contact dynamics (CD) is a powerful method to solve the dynamics of large systems of colliding rigid bodies. CD can be computationally more efficient than classical penalty-based discrete element methods (DEM) for simulating contact between…

Classical Physics · Physics 2018-05-22 Tyler Olsen , Ken Kamrin

In this paper, the surface of revolution discrete element method (SR-DEM) is introduced to simulate systems of particles with closed surfaces of revolution. Due to the cylindrical symmetry of a surface of revolution, the geometry of any…

Computational Engineering, Finance, and Science · Computer Science 2024-01-09 Fei-Liang Yuan

Contact involving soft materials often combines dry adhesion, sliding friction, and large deformations. At the local level, these three aspects are rarely captured simultaneously, but included in the theoretical models by Mergel et al.…

Computational Engineering, Finance, and Science · Computer Science 2020-12-03 Janine C. Mergel , Julien Scheibert , Roger A. Sauer

This paper provides a rigorous convergence rate and complexity analysis for a recently introduced framework, called PDE acceleration, for solving problems in the calculus of variations, and explores applications to obstacle problems. PDE…

Numerical Analysis · Mathematics 2019-07-31 Jeff Calder , Anthony Yezzi

We present a barrier method for treating frictional contact on interfaces embedded in finite elements. The barrier treatment has several attractive features, including: (i) it does not introduce any additional degrees of freedom or…

Numerical Analysis · Mathematics 2022-06-17 Yidong Zhao , Jinhyun Choo , Yupeng Jiang , Minchen Li , Chenfanfu Jiang , Kenichi Soga

We present non-convex maximal dissipation principle (NMDP), a time integration scheme for articulated bodies with simultaneous contacts. Our scheme resolves contact forces via the maximal dissipation principle (MDP). Prior MDP solvers…

Robotics · Computer Science 2020-10-29 Zherong Pan , Kris Hauser