[gmx-users] how to extract trajectories into individual pdb file?
Justin A. Lemkul
jalemkul at vt.edu
Thu May 3 18:00:18 CEST 2012
On 5/3/12 11:58 AM, Albert wrote:
> thank you very much.
>
> I found a problem : there is no option to select step. eg:
> I would like to export one snapshot at each 10ps, I don't find such kind of
> options......
>
That's what you can use -skip or -dt for. Alternatively, dump out frames at
specific times with -dump. Note that you can find all of this, and more, in the
help info printed by trjconv, as Mark originally suggested.
-Justin
> THX
>
> On 05/03/2012 05:21 PM, francesco oteri wrote:
>> -fit
>>
>> 2012/5/3 Albert <mailmd2011 at gmail.com <mailto:mailmd2011 at gmail.com>>
>>
>> On 05/03/2012 05:12 PM, francesco oteri wrote:
>>> In particular, look at the option -sep
>>
>>
>> thank you for kind reply. but how to superimposed the left snapshot with
>> the first one?
>>
>> thanks again for helps
>>
>> --
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>>
>>
>> --
>> Cordiali saluti, Dr.Oteri Francesco
>>
>>
>
>
>
--
========================================
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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