[gmx-users] Concatenating two trajectories

Justin A. Lemkul jalemkul at vt.edu
Wed Jul 20 13:16:41 CEST 2011



bipin singh wrote:
> Yes It is working....but I have not tried that, what would be the
> difference if I don't give -cat option........
> 

If the times are the same, then the second trajectory would have overwritten the 
first.  Please read the first paragraph of trjcat -h.

-Justin

> On Wed, Jul 20, 2011 at 16:16, Justin A. Lemkul <jalemkul at vt.edu> wrote:
>>
>> bipin singh wrote:
>>> Hello,
>>>
>>> I want concatenate two trajectories which have same number of frames
>>> and they have written for identical time period i.e. the simulation
>>> time is same for both the trajectories(for my case 100ns each) the
>>> only thing differ is the temperature of simulation.
>>> Please suggest me whether the below commands is right for
>>> concatenating these two trajectories:
>>>
>>> trjcat -f 1.xtc 2.xtc -o concat.xtc -cat
>>>
>> Presumably.  Did you try it?  Did it work?
>>
>> -Justin
>>
>> --
>> ========================================
>>
>> Justin A. Lemkul
>> Ph.D. Candidate
>> ICTAS Doctoral Scholar
>> MILES-IGERT Trainee
>> Department of Biochemistry
>> Virginia Tech
>> Blacksburg, VA
>> jalemkul[at]vt.edu | (540) 231-9080
>> http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
>>
>> ========================================
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> 
> 
> 

-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

========================================



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