[gmx-users] Re: installation problem for MAC OS

Yunan Yan yayan at chemie.fu-berlin.de
Thu Jan 24 11:14:56 CET 2008


Thank you so much. It works.

Best,
Yun-an


>
> Hello!
>
> A quick fix so that you will be able to compile, is to try to run the
> configure script with the flag --disable-ia32-sse.
> Hopefully you should get a working installation, but with no sse-
> support (which might be what you want :-)
>
> Cheers
> /Per
>
>
> 23 jan 2008 kl. 14.24 skrev Yunan Yan:
>
> >
> > Dear all,
> >
> > I have difficulties when I try to
> > install Gromacs 3.3.2 in my MAC OS.
> > Please see the following for details.
> >
> > configuration:
> >
> > $ ./configure CC=icc CXX=icc F77=ifort
> > --prefix=/Users/yunan/usr/local/Gromacs  --with-qmmm-cpmd --with-
> > fft=fftw3
> > CLAGS=-no-multibyte-chars CPP=/usr/bin/cpp
> >
> > System information:
> >
> > uname -m = i386
> > uname -r = 9.1.0
> > uname -s = Darwin
> > uname -v = Darwin Kernel Version 9.1.0: Wed Oct 31 17:46:22 PDT 2007;
> > root:xnu-1228.0.2~1/RELEASE_I386
> > /usr/bin/hostinfo      = Mach kernel version:
> >     Darwin Kernel Version 9.1.0: Wed Oct 31 17:46:22 PDT 2007;
> > root:xnu-1228.0.2~1/RELEASE_I386
> > Kernel configured for up to 8 processors.
> > 8 processors are physically available.
> > 8 processors are logically available.
> > Processor type: i486 (Intel 80486)
> > configure:3291: icc -V
> > Intel(R) C Compiler for applications running on IA-32, Version 10.1
> > Build 20070913 Package ID: m_cc_p_10.1.006
> > Copyright (C) 1985-2007 Intel Corporation.  All rights reserved.
> >
> > Error:
> > icc -funroll-all-loops -I/Users/yunan/usr/local/lib -framework
> > Accelerate
> > -o grompp topio.o toppush.o topcat.o topshake.o convparm.o tomorse.o
> > sorting.o splitter.o vsite_parm.o readir.o add_par.o topexcl.o
> > toputil.o
> > topdirs.o grompp.o compute_io.o  ../mdlib/.libs/libmd.a -L/usr/X11/lib
> > ../gmxlib/.libs/libgmx.a -lfftw3f /usr/X11/lib/libSM.6.0.0.dylib
> > /usr/X11/lib/libICE.6.3.0.dylib /usr/X11/lib/libX11.6.2.0.dylib
> > /usr/X11/lib/libXau.6.0.0.dylib /usr/X11/lib/libXdmcp.6.0.0.dylib
> > ld: in ../gmxlib/.libs/libgmx.a(nb_kernel204_ia32_sse.o), in section
> > __TEXT,__text reloc 1: bad pc-rel vanilla relocation length
> >
> > The same will happen when I use gcc compiler.
> > Does someone have some ideas about what's going on
> > here and how to figure it out?
> >
> > Thanks a lot.
> >
> > Best regards,
> > Yun-an
> >




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