MDStudio

A tool to run molecular dynamics workflows.

10
mentions
4
contributors
1403 commits | Last update: April 16, 2019

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What MDStudio can do for you

  • Molecular dynamics workflow creation and execution for biochemists
  • Micro-service based workflow management system
  • Flexible, interactive workflow execution locally or on HPC
  • Support for ATB, Gromacs, PLANTS, Paradocks, and many other tools

MDStudio provides biochemistry researchers in science and industry with the easiest and most flexible solution to running molecular dynamics-based workflows. It is community-developed open source software.

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Tags
  • Real time data analysis
  • High performance computing
  • Workflow technologies
Programming Language
  • Python
License
  • Apache-2.0
Source code

Participating organizations

Mentions

10 Presentations

Contributors

  • Felipe Zapata
    Netherlands eScience Center
  • Marc van Dijk
    VU University Amsterdam
  • Paul Visscher
    Zefiros Software
  • Mick van Duijn
    Zefiros Software
Contact person
Marc van Dijk
VU University Amsterdam