At the line 2266 of 'wat_nsn_md_25ns1.rst' I found:
1.6660392-226.3017434 306.7456514 20.9780993-225.6774003 306.9762293
I do not know what does it mean !!Please help me if you can.
regards,
Souvik Sur
Ph. D. Student
Department Of Chemistry
University Of Delhi
India
> Date: Mon, 5 Mar 2012 16:34:51 -0500
> From: jason.swails.gmail.com
> To: amber.ambermd.org
> Subject: Re: [AMBER] Error in amber output files
>
> Check your 'wat_nsn_md_25ns1.rst' file and see if there are any ****s in
> there. If there are, look for your error on the Amber mailing list and
> suggestions (specifically relating to setting iwrap=1).
>
> HTH,
> Jason
>
> On Mon, Mar 5, 2012 at 8:19 AM, souvik sur <souviksur.hotmail.com> wrote:
>
> >
> > Hello,
> > I am doing simulation of PNA:DNA duplex in amber9 using parmbsc0 force
> > field in a cluster, after running it for 25ns, when I submitted job for
> > further run I saw it was not running now and in the error file I found the
> > following lines:
> > At line 2266 of file _ew_setup.f (unit = 9, file =
> > 'wat_nsn_md_25ns1.rst')Fortran runtime error: Bad value during floating
> > point read
> > I can not get, where is the problem, Please help me regarding it.
> > thanks & regards,
> > Souvik Sur
> > Ph. D. Student
> > Department Of Chemistry
> > University Of Delhi
> > India
> >
> > _______________________________________________
> > AMBER mailing list
> > AMBER.ambermd.org
> > http://lists.ambermd.org/mailman/listinfo/amber
> >
>
>
>
> --
> Jason M. Swails
> Quantum Theory Project,
> University of Florida
> Ph.D. Candidate
> 352-392-4032
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Received on Mon Mar 05 2012 - 21:30:02 PST
