Does GROMACS have a multi-thread implementation, instead of using MPI?
___
gmx-users mailing listgmx-users@gromacs.org
http://www.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at http://www.gromacs.org/search before posting!
Please
Lee Soin wrote:
Does GROMACS have a multi-thread implementation, instead of using MPI?
No, at least not yet.
Carsten
___
gmx-users mailing listgmx-users@gromacs.org
http://www.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at
But I see that in mdrun there's an option nt--number of threads to start on
each node. Does this mean multi-thread?
2008/6/24 Carsten Kutzner [EMAIL PROTECTED]:
Lee Soin wrote:
Does GROMACS have a multi-thread implementation, instead of using MPI?
No, at least not yet.
Carsten
Lee Soin wrote:
But I see that in mdrun there's an option nt--number of threads to start
on each node. Does this mean multi-thread?
Yes, nt means number of threads. It's already there for a future version.
Carsten
___
gmx-users mailing list
For latest stable 3.3.3, there is no multi-thread implementation.
For CVS version for coming 4.0, might be, I am not sure, but that's only
for testing.
Your question tricky without indicating the version.
Regards,
Yang Ye
Lee Soin wrote:
But I see that in mdrun there's an option nt--number
Thanks!
2008/6/24 Carsten Kutzner [EMAIL PROTECTED]:
Lee Soin wrote:
But I see that in mdrun there's an option nt--number of threads to start
on each node. Does this mean multi-thread?
Yes, nt means number of threads. It's already there for a future version.
Carsten
6 matches
Mail list logo