[gmx-users] t_trxframe speed units

Berk Hess gmx3 at hotmail.com
Fri Sep 4 15:50:58 CEST 2009

I should have time next week to do this.
The problem with these kind of things is that you have
to make sure that it works under all conditions and that grompp
should have checks for all conditions under which it does not work.


> Date: Fri, 4 Sep 2009 13:27:46 +0200
> From: alexander.herz at mytum.de
> To: gmx-users at gromacs.org
> Subject: Re: [gmx-users] t_trxframe speed units
> sure,
> I'll update to the head revision as soon as a fix is available.
> Any idea how long this will take?
> Alex
> Berk Hess schrieb:
> > Thinking about this, I will probably not fix it in 4.0,
> > but only in git master for 4.1.
> >
> > There are several issues with pulling "infinitely" long/far.
> > One of them is that you can no longer determine the virial contribution

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