[gmx-users] request

Oliver Lange olange at gwdg.de
Mon Jun 7 09:50:35 CEST 2004

Hi Dinesh,

rename the file you used for the MD to topol.tpr or use the option
-s fullmd_sol.tpr to specify your own tpr -file.
The .tpr file is needed for many tools, so the easiest way is to have a topol.tpr in your 
directory when you do analysing.


Dinesh Pinisetty wrote:
> Hi everyone,
>       I am very sorry to disturb you all again,I know that there should be
> topol.tpr file but when I am running the simulation for DMPC the tpr files
> present in the directory where input.tpr and fullmd_sol.tpr.Should I rename
> one of them so that g_msd reads them and gives out the diffusivity values.
>      Is there any way to permanently sort out the problem so that code
> automatically reads the tpr file and gives out the diffusivity values.
>  Thanks all of you in advance.
> Thanking You,
> Dinesh.
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Oliver Lange
MPI for biophysical Chemistry
olange at gwdg.de
Fax: +495512012302
Tel: +495512012305

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