[gmx-users] Need help with installation on Itanium2

[Vasilii Artyukhov]

Yep, my mistake, I built the serial version using gcc previously, so the
problem really _is_ in Intel's compiler. I've finally figured out how to
make mpicc use gcc instead of Intel, so now I have a working MPI version of
GROMACS.

Thank you again,
Vasilii

2008/4/28 Mark Abraham <Mark.Abraham at anu.edu.au>:

>
> I get the same issue with GROMACS 3.3.2 and 3.3.3 on my Itanium2 system
> using Intel 10.1 icc, and I also get them even without --enable-mpi, e.g.
>
> ../configure --program-suffix=_3.3.3_single --with-fft=fftw2
> --with-external-blas --with-external-lapack
> LIBS="-L/opt/fftw-2.1.5/intel-9.1/lib -lscs"
>
> then make gives
>
> /bin/sh ../../../../libtool   --mode=compile icc -DHAVE_CONFIG_H -I.
> -I../../../../src
> -I../../../../../src/gmxlib/nonbonded/nb_kernel_ia64_single
> -I../../../../../include -DGMXLIBDIR=\"/usr/local/gromacs/share/top\" -O3 -w
> -funroll-all-loops -MT nb_kernel010_ia64_single.lo -MD -MP -MF
> .deps/nb_kernel010_ia64_single.Tpo -c -o nb_kernel010_ia64_single.lo
> ../../../../../src/gmxlib/nonbonded/nb_kernel_ia64_single/nb_kernel010_ia64_single.S
>  icc -DHAVE_CONFIG_H -I. -I../../../../src
> -I../../../../../src/gmxlib/nonbonded/nb_kernel_ia64_single
> -I../../../../../include -DGMXLIBDIR=\"/usr/local/gromacs/share/top\" -O3 -w
> -funroll-all-loops -MT nb_kernel010_ia64_single.lo -MD -MP -MF
> .deps/nb_kernel010_ia64_single.Tpo -c
> ../../../../../src/gmxlib/nonbonded/nb_kernel_ia64_single/nb_kernel010_ia64_single.S
> -o nb_kernel010_ia64_single.o
> /tmp/iccEJOKXd.s(1) : error A2040: Unexpected token: Unary Diez Operator
> at: Start
> ...etc
>
> Running the above icc by hand with -O0 also fails in the same way.
>
>
> Mark
> _______________________________________________
> gmx-users mailing list    gmx-users at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please search the archive at http://www.gromacs.org/search before posting!
> Please don't post (un)subscribe requests to the list. Use the www
> interface or send it to gmx-users-request at gromacs.org.
> Can't post? Read http://www.gromacs.org/mailing_lists/users.php
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20080428/8f398cdd/attachment.html>