[gmx-users] nt/ntmpi/ntomp

Mahmood Naderan mahmood.nt at gmail.com
Sat Oct 22 12:37:04 CEST 2016


Hi,
What is the clear difference among nt, ntmpi and ntomp? I have built
gromacs with MPI suppport. Then I run

mpirun gmx_mpi mdrun

Simply I want to know, is it a good idea to use 'nt' for such command? Are
there some conflicts among them which degrade the performance? For example,
using 'nt' for mpirun degrades the performance. Is that correct?

How about ntomp?
I read the descriptions for them, but I expect to see a table that shows
which switch is valid/invalid for a platform.



Regards,
Mahmood


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