ePubs
The open archive for STFC research publications
Home
About ePubs
Content Policies
News
Help
Privacy/Cookies
Suggest an Enhancement
Contact ePubs
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
MA Seaton (STFC Daresbury Lab.)
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
software development
,
DL_MESO
,
mesoscale modelling
,
DL_POLY
,
dissipative particle dynamics
Funding Information
EPSRC
Related Research Object(s):
49828652
Licence Information:
Language
English (EN)
Type
Details
URI(s)
Local file(s)
Year
Journal Article
Mol Simul
47, no. 2-3 (2018): 228-247.
doi:10.1080/08927022.2018.1524143
2018
Showing record 1 of 1
Recent Additions
Browse Organisations
Browse Journals/Series
Login to add & manage publications and access information for OA publishing
Username:
Password:
Useful Links
Chadwick & RAL Libraries
SHERPA FACT
SHERPA RoMEO
SHERPA JULIET
Journal Checker Tool
Google Scholar