[gmx-users] how to increase the number of

Mark Abraham Mark.Abraham at anu.edu.au
Fri May 18 05:08:46 CEST 2007

Pradeep Kota wrote:
> Hi Afonso,
> An easier way would be to use the -time flag with grompp. it would 
> basically set the first time frame for the new tpr to what you give it. 
> jus play around with it and i'm sure you can get what you wanted. dont 
> forget to include the -np flag of course. :)

No, that's not what grompp -time is for. See the man page. If you want 
to pretend it's the same simulation, by having the step numbering start 
from wherever you're up to, then there is an .mdp flag you can set. See 
section 7.3 of the manual.


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