Hi dac,
Thanks for the patch, I installed the patch and made clean.
I then reconfigured and used the new configure.h file and then made install
again.
I now get this new error.
escf = escf + pm6_correction()
1
Error: Function 'pm6_correction' at (1) has no IMPLICIT type
make[1]: *** [qm2_energy.SQM.o] Error 1
make[1]: Leaving directory
`/home/common/packages/amber11/AmberTools/src/sqm'
make: *** [serial] Error 2
Are there other patches that I need to install?
I used the AmberTools-bugfix.all from the website.
Thanks
Vivek
(The test suite still failed the same number of tests as before)
On Sun, May 29, 2011 at 11:54 AM, case <case.biomaps.rutgers.edu> wrote:
> On Fri, May 27, 2011, Vivek Shankar Bharadwaj wrote:
> >
> > I was trying to install Amber11 on my machine and ran into some
> > difficulties.
> >
> > I am using Fedora 15 64-bit OS.
> >
> > double precision function hofCorrection()
> > 1
> > Error: In generic interface 'pm6_correction' at (1) procedures must be
> > either all SUBROUTINEs or all FUNCTIONs
> > make[1]: *** [qm2_pm6_hof_module.o] Error 1
> > make[1]: Leaving directory
> > `/home/common/packages/amber11/AmberTools/src/sqm'
> > make: *** [serial] Error 2
>
> Try applying the attached patch to the file
> $AMBERHOME/AmberTools/src/sqm/qm2_pm6_hof_module.f.
>
> I suspect that this needs to be a bugfix; it's in the master branch of git
> right now, but is clearly a kludge. Some Amber developer more familiar
> with
> the code should figure out if it would really be better to make
> hofCorrection() a subroutine rather than a function.
>
> ....dac
>
>
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Received on Mon May 30 2011 - 10:00:02 PDT
