[gmx-users] How to install MPI version of Gromacs on a Linux Cluster

Andrea Carotti and.carotti at farmchim.uniba.it
Mon Mar 27 13:02:16 CEST 2006

Here http://www.gromacs.org/documentation/howtos/mpich_howto.html you'll 
find an interesting solution for you..
----- Original Message ----- 
From: "Shankar Prasad Kanaujia" <spk at rishi.serc.iisc.ernet.in>
To: <gmx-users-request at gromacs.org>
Cc: <gmx-users at gromacs.org>
Sent: Monday, March 27, 2006 8:03 AM
Subject: [gmx-users] How to install MPI version of Gromacs on a Linux 

> Dear Gromacs Users,
> I am a new user of gromcas. But I have problem in installing mpi
> version of gromacs on a cluster which has the following
> configurations:
> 1. It has 8 nodes.
> 2. Each node has PIV 3.4 GHz and having 2 GB RAM.
> 3. Redhat Enterprise Linux 4.0
> 4. MPICH-1.2.5 version
> I do not know how to install MPI version of Gromacs. What files I need to
> edit.
> I request you all to kindly tell me the steps to install MPI version of
> gromacs on the cluster. (Note: I am able to install gromacs on a single
> processor machine.)
> I would be highly grateful for the same.
> Thanking you.
> Yours Sincerely,
> --
> Shankar Prasad Kanaujia
> Ph.D Student
> Bioinformatics Center, Department of SERC
> IISc, Bangalore - 12
> Mobile: 9845631581
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