Hello,
Your suggestion works for me. I accidentally removed the newline without
knowing. Thank you again for your help.
On Fri, Dec 3, 2021 at 2:03 AM tluchko <tluchko.protonmail.com> wrote:
> > (unit = 10, file = 'test.inp')
> > Fortran runtime error: End of file
>
> I'll also point out that the error report is in reading 'test.inp', not
> the MDL file. This is commonly due to a problem with the namelist format,
> such as missing a newline character after the closing `/`.
>
> Tyler
>
> Sent with ProtonMail Secure Email.
>
> ‐‐‐‐‐‐‐ Original Message ‐‐‐‐‐‐‐
>
> On Thursday, December 2nd, 2021 at 5:17 AM, David A Case <
> david.case.rutgers.edu> wrote:
>
> > On Thu, Dec 02, 2021, Alexis Azucena wrote:
> >
> > > I am running 1D-RISM for the water-glycol system. I generated my *.mdl
> *file
> > >
> > > for the glycol as shown below:
> > >
> > > %FLAG POINTERS
> > >
> > > %FORMAT(10I8)
> > >
> > > 10 4
> > >
> > > %FLAG ATMTYP
> > >
> > > %FORMAT(10I8)
> > >
> > > 1 2 3 4
> >
> > Above looks wrong: the "10I8" is a fortran format, which says that each
> >
> > integer should take eight columns. Try changing this to
> >
> > %FLAG POINTERS
> >
> > %FORMAT(10I8)
> >
> > 10 4
> >
> > %FLAG ATMTYP
> >
> > %FORMAT(10I8)
> >
> > 1 2 3 4
> >
> > ...hope this helps....dac
> >
> > AMBER mailing list
> >
> > AMBER.ambermd.org
> >
> > http://lists.ambermd.org/mailman/listinfo/amber
>
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--
*Alexis G. Azucena, RChE*
Instructor II
*School of Technology*
University of the Philippines Visayas
*mobile: *+63917 584 1130 *|* +63918 214 1401
*email: *agazucena.up.edu.ph
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Received on Thu Dec 02 2021 - 18:00:02 PST
