[gmx-users] Selecting Nodes While Running Parallel Mdrun

cesar inmuno_cl at yahoo.com
Tue Apr 25 16:37:57 CEST 2006

If you are using Lam/mpi you have to lamboot as much as nodes as you 
want in the hostfile, you must specify the number of nodes as well as 
their IP.


Shankar Prasad Kanaujia escribió:
> Dear Gromacs Users,
> I am installing parallel version of gromacs on linux cluster, but I do not 
> want to use all the nodes for my simulation. Is there any way to select 
> some specific nodes for simulation ?
> Will I have to specify the nodes while installing or I would be able to 
> select the nodes after installation according to my requirement ?
> What are the necessary files to be edited for the same ?
> Thanks,
> Shankar Prasad Kanaujia
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