[gmx-users] Installing & uninstalling of gromacs

Spring buds winterhot82 at gmail.com
Mon Jan 23 18:53:10 CET 2012

Dear Gromacs users,


I am very new users and I am trying to install grmacs 4.5.5 or 3.3.3 for
past four days. But still I am not able to. So I would like to ask some
questions which are below.

1.My laptop is a dual core, which means two processors?.So should I need to
install MPI?

2.I installed gromacs 4.5.5 with mistakes. To remove installing, I used the
"which gromacs" and it shows as "/usr/bin/which: no mdrun in
However, I used "rm -rf /usr/local/gromacs" to remove installing I still
can see tha gromacs files with red background in "/usr/local/bin". Could
you tell me I removed the gromacs installing?

3.Could you please tell me the very simple steps for installatios, since I
am a novice.

Many thanks in advance for your time and help.

Huang Malai
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20120124/905d149a/attachment.html>

More information about the gromacs.org_gmx-users mailing list