[gmx-users] Restarting after NVT: continuation error

[Amit Choubey]

On Tue, May 25, 2010 at 2:32 PM, VANDANA KUMARI <
kumari.5 at buckeyemail.osu.edu> wrote:

>
> Hello Gromacs Users,
>
> I am trying to make tpr file for NPT equilibration after NVT equilibration
> using
>
> grompp -f npt.mdp -c nvt.gro -t nvt.trr -p topol.top -n index.ndx -o
> npt.tpr
>

> I am using  parameter " continuation = yes " in npt.mdp  for restarting
> after NVT, but I am getting this warning massage:
>

>  WARNING 1 [file npt.mdp, line unknown]:
>   Unknown left-hand 'continuation' in parameter file
>
>
well to continue why dont you use the same velocities ; just say gen_vel =
no

amit

> Please help me with this issue.
>
> Thank you
> --
> Vandana
>
>
>
>
>
>
>
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