I had trouble compiling gromacs-3.3.1 parallel (but not serial) on
itanium2 until I found the following post:
http://www.gromacs.org/pipermail/gmx-users/2004-February/009171.html
And that solution was good... I now have a functional executable.
To clarify, the solution was to do this:
export CFLAGS="-nocpprt"
before compiling gromacs.
Note also that I use a compilation script and when I put this in my
compilation script it did not have any effect. I had to do it from the
command line before running the script for it to work.
I posted this for 2 reasons:
1) to clarify the solution for those who will compile in the future.
2) to suggest that this gets incorporated into the ./configure script
for the future.
$ cc --version
icc (ICC) 9.1 20061105
Copyright (C) 1985-2006 Intel Corporation. All rights reserved.
$ f77 --version
ifort (IFORT) 9.1 20061105
Copyright (C) 1985-2006 Intel Corporation. All rights reserved.
Chris.
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