hello,
I use the version 1.0.0. I get the same results as yours, but written on my console not in the file I have specified with the --outputfile=1dlhAPO.out option.
Kind regards
Francois





> Message du 20/05/08 13:16
> De : "Nathan Baker"
> A : "François BAGAINI"
> Copie à : apbs-users@lists.sourceforge.net
> Objet : Re: [Apbs-users] Outputfile with APOLAR calculations
>
> Hello --
>
> This example ran on my computer with the attached output. What
> version of APBS are you using?
>
> Thanks,
>
> Nathan
>
>
>
> On May 20, 2008, at 5:23 AM, François BAGAINI wrote:
>
> > Hello Nathan,
> > Here are my files. I have used OPLS parameters because it was easier
> > for me but I'm working on Amber parameters for further calculations.
> > Thanks for your help.
> > Francois
> >
> >
> >
> >
> >
> > > Message du 20/05/08 03:13
> > > De : "Nathan Baker"
> > > A : "bagaini.fr"
> > > Copie à : apbs-users@lists.sourceforge.net
> > > Objet : Re: [Apbs-users] Outputfile with APOLAR calculations
> > >
> > > Hello --
> >
> > >
> > Can you please send the input file and PQR so we can know a bit more
> > about the setup of your system?
> >
> > >
> > Thanks,
> >
> > >
> > Nathan
> >
> > >
> > On May 19, 2008, at 2:50 PM, bagaini.fr wrote:
> >
> > Hi,
> > I use APBS on a windows XP plateform. I have performed ELEC
> > calculations with an outputfile specification to write the results
> > in a file. But when I do the same with APOLAR settings the file is
> > created, the date and time are written in the file...and that all!
> > What should I have done?
> > Thanks a lot for your help.
> > Francois
> > -------------------------------------------------------------------------
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> > >
> >
> >
> >
> > >
> > --
> > Associate Professor, Dept. of Biochemistry and Molecular Biophysics
> > Center for Computational Biology, Washington University in St. Louis
> > Web: http://cholla.wustl.edu/
> >
> >
> >
> >
> >
> >
> >
> >
> >
> >
> > >
> >
> >
> > <1dlhAPO.in><1dlh_pep.pqr><1dlh.pqr>
>
> --
> Associate Professor, Dept. of Biochemistry and Molecular Biophysics
> Center for Computational Biology, Washington University in St. Louis
> Web: http://cholla.wustl.edu/
>
>
>
>
>
>
>
> [ (pas de nom de fichier) (0.0 Ko) ]