[gmx-users] how to change the timestamp of a xtc file

lina lina.lastname at gmail.com
Thu Apr 5 12:18:34 CEST 2012


On Thu, Apr 5, 2012 at 6:07 PM, Mark Abraham <mark.abraham at anu.edu.au> wrote:
>
>
> On 05/04/12, lina <lina.lastname at gmail.com> wrote:
>
> On Thu, Apr 5, 2012 at 4:42 PM, Peter C. Lai <pcl at uab.edu> wrote:
>> trjcat -settime or trjconv -t0
>
> Thank you, a further question, a trjcat-ed  xtc file, which timestamp like
>
> 0-5 0-2 0-5 0-3 ...
>
> Are there someway to update them all in the trjcated ones?
>
>
> I've no idea what you mean, but trjconv -settime is still your friend.

sorry I didn't say it clearly.

Well, I mean several xtc files
all starts with 0
but ends with 1 ns, 2 ns, 1 ns

I use trjcat -cat combine them together. now I wonder can make the
time continuously.

from 0 to 4ns.

Thanks,


>
> Mark
>
>
>
>
> Thanks ahead,
>
>>
>> On 2012-04-05 03:59:44PM +0800, lina wrote:
>>> Hi,
>>>
>>> A quick question, how can I change the .xtc file which beginning at 0,
>>> end at 1 ns to beginning at 5ns and end at 6ns.
>>>
>>> Thanks for any suggestions,
>>>
>>> Best regards,
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>>
>> --
>> ==================================================================
>> Peter C. Lai                    | University of Alabama-Birmingham
>> Programmer/Analyst              | KAUL 752A
>> Genetics, Div. of Research      | 705 South 20th Street
>> pcl at uab.edu                     | Birmingham AL 35294-4461
>> (205) 690-0808                  |
>> ==================================================================
>>
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