[gmx-users] append simulation

Nilesh Dhumal ndhumal at andrew.cmu.edu
Tue May 5 02:03:59 CEST 2015


>
>
> On 5/4/15 6:08 PM, Nilesh Dhumal wrote:
>> Hello Gromacs Users,
>>
>> I have finished 30ns simulation and I want to run 30ns more.
>> If I use append yes, will it append to existing trajectory file.
>> Will I get the final 60 ns trajectory.
>>
>
> Well, that's the exact purpose of the -append option does, so yes.
>
> -Justin
>

I checked md.log file by tail md.log and step number were from 1 instead
of 30000001.

Nilesh


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> Justin A. Lemkul, Ph.D.
> Ruth L. Kirschstein NRSA Postdoctoral Fellow
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