[gmx-users] mdrun_mpi

David van der Spoel spoel at xray.bmc.uu.se
Wed Apr 17 22:06:45 CEST 2002


On Wed, 17 Apr 2002, Chandrasekar Ramamoorthy wrote:

>Could some one please tell me the difference between
>using the mdrun_mpi command and mpirun -c N mdrun
>command.
mdrun_mpi is compiled for mpi, but sometimes mdrun also is.
You'll find out soon engouh when you try to run mpirun and mdrun is not 
compiled for MPI.

Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576,  	75123 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://zorn.bmc.uu.se/~spoel
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