https://github.com/carlocamilloni/labtools

Lab tools: scripts, force fields, protocols to support the setup of MD simulations
https://github.com/carlocamilloni/labtools

Last synced: 5 days ago
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Lab tools: scripts, force fields, protocols to support the setup of MD simulations

• Host: GitHub
• URL: https://github.com/carlocamilloni/labtools
• Owner: carlocamilloni
• Created: 2018-01-19T09:53:31.000Z (almost 7 years ago)
• Default Branch: main
• Last Pushed: 2024-03-21T19:33:50.000Z (8 months ago)
• Last Synced: 2024-11-02T12:34:11.246Z (12 days ago)
• Language: C++
• Homepage: http://compsb.unimi.it
• Size: 51.9 MB
• Stars: 7
• Watchers: 3
• Forks: 3
• Open Issues: 0
• Metadata Files:
  • Readme: README.md

Awesome Lists containing this project

README

        
# labtools

Here you can find tools and resources we frequently use in our work

- force-fields: some force-field implementations for gromacs

- gromacs-tools: some modified gromacs tools

- hpc: stuff usefull for computer clusters 

- martini: specific tools and force fields for martini

- mdps: some gromacs option files for common MD cases

- plumed-stuff: scripts for the analysis of the results of enhanced sampling MD

- tutorials: learn how to run metainference simulations and more