ePubs

The open archive for STFC research publications

Full Record Details

Persistent URL http://purl.org/net/epubs/work/39595226
Record Status Checked
Record Id 39595226
Title DL_MESO_DPD: development and use of mesoscale modelling software
Contributors
Abstract DL_MESO is a highly-scalable general purpose software package for mesoscale modelling. Created and developed at Daresbury Laboratory for the UK Collaborative Computational Project CCP5, it was intended to be a companion package to the flagship molecular dynamics code DL_POLY. One of DL_MESO component codes, DL_MESO_DPD, is based on dissipative particle dynamics, a mesoscale modelling technique with many similarities to classical molecular dynamics. While this code and DL_POLY were created with different applications in mind, they share a significant amount of functionality and development history. This article gives an overview on how DL_MESO_DPD has been developed, including its shared history with DL_POLY and information on its current performance, and a selection of applications for which the code has been used.
Organisation STFC , SCI-COMP , SCI-COMP-CC
Keywords DL_POLY , software development , dissipative particle dynamics , DL_MESO , mesoscale modelling
Funding Information Engineering and Physical Sciences Research Council
Related Research Object(s):
Language English (EN)
Type Details URI(s) Local file(s) Year
Journal Article Mol Simul (2018). doi:10.1080/08927022.2018.1524143 2018
Showing record 1 of 1