[gmx-users] gmxdump question

[K.A. Feenstra]

David wrote:
> On Tue, 2002-12-24 at 20:38, Dmitry Kovalsky wrote:
> 
>>Hi there 
>>
>>Mary Christmas to everybody and Happy New Year!
>>
>>if I do a simulation from tpr file that was produced by tpbconv after a crash.
>>
>>How I can get an info from the file using gmxdump about initial nsteps not 
>>those left.  If I use gmxdump -s mol_2.tpr|grep nsteps
> 
> just do gmxdump -s mol_2.tpr | more
> you will see all the information in there, initial steps is not a
> variable, but init_t (time) is.

If you need to know the step number, it should be stored in the .trr
file. Try gmxdump -f traj.trr | more


-- 
Groetjes,

Anton
  ________ ___________________________________________________________
|        | Anton Feenstra                                            |
| .      | Dept. of Pharmacochemistry - Vrije Universiteit Amsterdam |
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