[gmx-users] Re: Problem with pressure coupling

[Berk Hess]

Well, this happens to everybody.
The search feature is bugzilla is far too complex.
We are considering switching to a more powerful and easier system.

Berk

> Date: Thu, 7 Oct 2010 12:41:17 +0200
> Subject: Re: [gmx-users] Re: Problem with pressure coupling
> From: ondrej.marsalek at gmail.com
> To: gmx-users at gromacs.org
> 
> Hi,
> 
> thanks for fixing this, Berk. Silly me, I did not include RESOLVED
> bugs in my original search and therefore missed it.
> 
> Ondrej
> 
> 
> On Thu, Oct 7, 2010 at 12:38, Berk Hess <gmx3 at hotmail.com> wrote:
> > Hi,
> >
> > It's bugzilla 579:
> > http://bugzilla.gromacs.org/show_bug.cgi?id=579
> > Actually the title is wrong, the pressure was correct, the pressure scaling,
> > and thus the density, not.
> >
> > Berk
> >
> >> Date: Thu, 7 Oct 2010 12:28:15 +0200
> >> Subject: Re: [gmx-users] Re: Problem with pressure coupling
> >> From: ondrej.marsalek at gmail.com
> >> To: gmx-users at gromacs.org
> >>
> >> On Wed, Sep 29, 2010 at 21:56, David van der Spoel <spoel at xray.bmc.uu.se>
> >> wrote:
> >> >
> >> > After setting nstcalcenergy = 1 I get
> >> > Density        996.894        1.2    3.85083    1.86718  (kg/m^3)
> >> >
> >> > In other words the bug can be circumvented by setting this variable to
> >> > 1. I
> >> > will file a bugzilla.
> >> >
> >>
> >> Is this bug in now? I can't find it in recent bugs, but perhaps I've
> >> missed it. If it is not in, should I file it?
> >>
> >> Regards,
> >> Ondrej
> >> --
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