[gmx-users] can i run .tpr using Gromacs 4.5.3(has parallel) in cluster computer; the .tpr was created using gromacs 4.0.7 in my desktop (without parallel)
roland at utk.edu
Thu Jan 27 06:05:14 CET 2011
Yes. But it is better to use the same version. Otherwise you can't set all
parameters (e.g. nstcalcenergy)
2011/1/26 gromacs <ptf1242 at 163.com>
> Hi guys,
> I created my .tpr through my own desktop (without parallel) using gromacs
> can i run .tpr parallelly using Gromacs 4.5.3(has parallel) in cluster
> I want creat all my .tpr files in my own computer, and then run on HPC
> (High performance computer).
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