[gmx-users] How to restart the crashed run

Mark Abraham mark.j.abraham at gmail.com
Tue Sep 17 08:06:55 CEST 2013

http://www.gromacs.org/Documentation/How-tos/Doing_Restarts suggests
the 3.x-era restart strategy when checkpoint files are unavailable.
But if you simply have no output files, then you have no ability to


On Tue, Sep 17, 2013 at 1:59 AM, Mahboobeh Eslami
<mahboobeh.eslami at yahoo.com> wrote:
> hi my friends
> please help me
> i did 20 ns simulation by gromacs 4.5.5 but the power was shut down near the end of the simulation
> How to restart the crashed run?
>  in the gromacs.org following comment has been proposed
> mdrun -s topol.tpr -cpi state.cpt
> but i don't have state.cpt in my folder.
> I need urgent help
> Thank you very much
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