[gmx-users] which tpr?

Mark Abraham mark.abraham at anu.edu.au
Tue Jul 3 06:44:28 CEST 2007


> Hey :)
>
> Errm, trjconv does read coordinates, so when using -fit or -pbc
> nojump, the results will depend on the structure file used.
>
> Tsjerk
>
> On 7/3/07, Mark Abraham <mark.abraham at anu.edu.au> wrote:
>> trjconv just needs any old structure file. You can see this if you
>> follow
>> my suggestion at the top of this post
>> http://www.gromacs.org/pipermail/gmx-users/2007-July/028367.html

Ermm yes. I should have said "trjconv just needs a file with the structure
you want in any old structure format"

Mark




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