[gmx-developers] Suggestion: warning for trjconv -ur compact

Berk Hess hessb at mpip-mainz.mpg.de
Thu Oct 9 11:07:56 CEST 2008


Hi,

There already was a warning like this in trjconv, but the check was not 
strict enough.
I fixed it.

Berk

Jochen Hub wrote:
> Hi,
>
> I suggest to report a warning in trjconv when using -ur compact
> *without* using -pbc atom or -pbc mol. In that case, -ur compact doesn't
> work which may cause some confusion (and did confuse me yesterday :) ).
>
> Thanks to Erik for helping me out with that issue.
>
> I added that minor issue to the 'wishlist' in the wiki.
>
> Cheers, Jochen
>
>
>
>   




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