Gromacs 2016.3 on /opt/netapps: Difference between revisions

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The latest version of Gromacs has been made available to all LWP users via networked storage.
[[Category:software-faq]]
A version of Gromacs has been made available to all LWP users via networked storage.


To set up your environment to work with the software, run the following command:
To set up your environment to work with the software, run the following command:
  GMXRC
  source GMXRC


You can add this command to your ~/.bashrc file, so it is automatically run every time you open a terminal.
You can add this command to your ~/.bashrc file, so it is automatically run every time you open a terminal.


After this gromacs should be in your standard PATH and you can start it with the command:
After this you can start it with the command:
  gmx
  gmx

Latest revision as of 09:51, 14 August 2018

A version of Gromacs has been made available to all LWP users via networked storage.

To set up your environment to work with the software, run the following command:

source GMXRC

You can add this command to your ~/.bashrc file, so it is automatically run every time you open a terminal.

After this you can start it with the command:

gmx