Re: [AMBER-Developers] compile failure on cray xt4

From: Jason Swails <jason.swails.gmail.com>
Date: Thu, 4 Nov 2010 07:45:01 -0400

The line is:

use softcore, only : nsc, ifsc

It does, however, use qmmm_module, which in turn uses qmmm_vsolv_module.
I'm not exactly sure why it's failing. I'll try with a fresh git tree and
report back.

Thanks!
Jason

On Wed, Nov 3, 2010 at 9:06 PM, Andreas Goetz <agoetz.sdsc.edu> wrote:

> Hi Jason,
>
> I can't reproduce this error on my linux box (opensuse 11.2 with gcc
> 4.4.1). I tried with a fresh checkout.
>
> What puzzles me is that the module qmmm_vsolv_module is not used in
> nonbond_list.f. What does line 1523 of _nonbond_list.f contain in your case?
> Maybe I am overlooking something here.
>
> All the best,
> Andy
>
> On Nov 3, 2010, at 4:02 PM, Jason Swails wrote:
>
> > Hello,
> >
> > I was trying to compile a fresh checkout of the amber tree, and I ran
> into
> > the following failure:
> >
> > PGF90-F-0004-Unable to open MODULE file qmmm_vsolv_module.mod
> > (_nonbond_list.f: 1523)
> > PGF90/x86-64 Linux 10.6-0: compilation aborted
> >
> > It appears that copying the sqm module files into the sander directory
> fixed
> > things... I figured I'd pass on this report if it's in fact an issue on
> > more than just athena with my setup.
> >
> > Thanks!
> > Jason
> >
> > --
> > Jason M. Swails
> > Quantum Theory Project,
> > University of Florida
> > Ph.D. Graduate Student
> > 352-392-4032
> > _______________________________________________
> > AMBER-Developers mailing list
> > AMBER-Developers.ambermd.org
> > http://lists.ambermd.org/mailman/listinfo/amber-developers
>
> --
> Dr. Andreas W. Goetz
> San Diego Supercomputer Center
> Tel : +1-858-822-4771
> Email: agoetz.sdsc.edu
> Web : www.awgoetz.de
>
>
>
>
>
> _______________________________________________
> AMBER-Developers mailing list
> AMBER-Developers.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber-developers
>



-- 
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
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Received on Thu Nov 04 2010 - 05:00:05 PDT
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