An effective bead-spring model for polymer simulation

DOI10.1016/J.JCP.2007.11.012MaRDI QIDQ2479482zbMATH OpenOpenAlexWikidataFDO

Authors Bin Liu, Jizeng Wang, Xiaojun Fan, Yong Kong, Huajian Gao

Publication date 26 March 2008

Published in Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/j.jcp.2007.11.012

zbMATH Keywords

polymer dynamicsbead-spring modelbead-rod modelBrownian dynamic simulationsflexible polymerfreely jointed chain model

Mathematics Subject Classification ID

Statistical mechanics of polymers (82D60)

Recommendations

• Brownian dynamics simulations of bead-rod and bead-spring chains: Numerical algorithms and coarse-graining issues.
• An alternative to the bead-rod model: bead-spring chains with successive fine graining
• Dynamic simulation of freely draining flexible polymers in steady linear flows
• Accuracy of bead-spring chains in strong flows
• Cost-effective multi-mode FENE bead-spring models for dilute polymer solutions

Cites work

• A combined wormlike-chain and bead model for dynamic simulations of long linear DNA
• Brownian dynamics simulations of bead-rod and bead-spring chains: Numerical algorithms and coarse-graining issues.

Cited in

(12)

• Consistent model reduction of polymer chains in solution in dissipative particle dynamics: model description
• Rheological modeling with Hookean bead-spring cubes (SC, BCC and FCC)
• Molecular dynamics simulation of AFM studies of a single polymer chain
• Brownian dynamics simulation of reversible polymer networks using a non-interacting bead-and-spring chain model
• Review on the Brownian dynamics simulation of bead-rod-spring models encountered in computational rheology
• scientific article; zbMATH DE number 841194 (Why is no real title available?)
• scientific article; zbMATH DE number 2232768 (Why is no real title available?)
• A computationally efficient approach for Hi fidelity fine graining from bead-spring models to bead-rod models
• A finitely extensible bead-spring chain model for dilute polymer solutions
• Varying the resolution of the rouse model on temporal and spatial scales: application to multiscale modeling of DNA dynamics
• Semiflexible polymer dynamics with a bead-spring model
• Brownian dynamics simulation of finitely extensible bead-spring chains

Describes a project that uses

Uses Software

• LINCS

This page was built for publication: An effective bead-spring model for polymer simulation

Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q2479482)