نتایج جستجو برای: langevin dynamics simulation

تعداد نتایج: 942603  

Journal: :The Journal of chemical physics 2014
Ellen Fischermeier Matthieu Marechal Klaus Mecke

We study a model colloidal liquid crystal consisting of hard spherocylinders under the influence of an external aligning potential by Langevin dynamics simulation. The external field that rotates in a plane acts on the orientation of the individual particles and induces a variety of collective nonequilibrium states. We characterize these states by the time-resolved orientational distribution of...

2016
Anqi Ling Yandong Huang Jianwei Shuai Yueheng Lan

Internal and external fluctuations, such as channel noise and synaptic noise, contribute to the generation of spontaneous action potentials in neurons. Many different Langevin approaches have been proposed to speed up the computation but with waning accuracy especially at small channel numbers. We apply a generating function approach to the master equation for the ion channel dynamics and furth...

Journal: :Physical review letters 2000
E Granato S C Ying

We study the response of an adsorbed monolayer under a driving force as a model of sliding friction phenomena between two crystalline surfaces with a boundary lubrication layer. Using Langevin-dynamics simulation, we determine the nonlinear response in the direction transverse to a high symmetry direction along which the layer is already sliding. We find that below a finite transition temperatu...

Journal: :Physical review. E, Statistical, nonlinear, and soft matter physics 2009
Chiu Fan Lee James Loken Létitia Jean David J Vaux

Protein amyloid fibrils are a form of linear protein aggregates that are implicated in many neurodegenerative diseases. Here, we study the dynamics of amyloid fibril elongation by performing Langevin dynamic simulations on a coarse-grained model of peptides. Our simulation results suggest that the elongation process is dominated by a series of local minimum due to frustration in monomer-fibril ...

Journal: :Physical review. E, Statistical, nonlinear, and soft matter physics 2003
David R Heine Gary S Grest Edmund B Webb

The spreading of polymer droplets is studied using molecular dynamics simulations. To study the dynamics of both the precursor foot and the bulk droplet, large hemispherical drops of 200 000 monomers are simulated using a bead-spring model for polymers of chain length 10, 20, and 40 monomers per chain. We compare spreading on flat and atomistic surfaces, chain length effects, and different appl...

Journal: :The Journal of chemical physics 2016
Georgios Arampatzis Markos A Katsoulakis Luc Rey-Bellet

We demonstrate that centered likelihood ratio estimators for the sensitivity indices of complex stochastic dynamics are highly efficient with low, constant in time variance and consequently they are suitable for sensitivity analysis in long-time and steady-state regimes. These estimators rely on a new covariance formulation of the likelihood ratio that includes as a submatrix a Fisher informati...

2011
Anping Chen Yi Chen Kanishka Perera

Recently, the subject of fractional differential equations has emerged as an important area of investigation. Indeed, we can find numerous applications in viscoelasticity, electrochemistry, control, electromagnetic, porous media, and so forth. In consequence, the subject of fractional differential equations is gaining much importance and attention. For some recent developments on the subject, s...

Journal: :Physical review. E, Statistical, nonlinear, and soft matter physics 2013
Mingcheng Yang Marisol Ripoll

The Langevin description of Brownian motion in inhomogeneous suspensions is here revisited. Inhomogeneous suspensions are characterized by a position-dependent friction coefficient, which can significantly influence the dynamics of the suspended particles. Outstanding examples are suspensions in confinement or in the presence of a temperature gradient. The Langevin approach in inhomogeneous sys...

Journal: :The Journal of Chemical Physics 2004

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