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Not a direct response but a thought: Wouldn't it be wonderful to
have a code that combined the best qualities of Gromacs and Blue
Matter? Is it possible to assemble a group or community of people
to do that?<br><br>
At 05:15 PM 4/3/2007, you wrote:<br>
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<font face="Courier New, Courier" size=2>Howdy,<br>
<br>
We are bringing a one rack (1024 node) IBM Blue Gene/L system online.
I've been tasked with compiling Gromacs for the Blue Gene. We have the XL
compilers installed (blrts_xlc / mpixlc, etc), so I'll be using those
rather than GNU.<br>
<br>
Has anyone on here successfully cross compiled Gromacs for use on BG/L
and if so, would you mind sharing your ./configure command options?<br>
<br>
This will be the first real application that I've compiled for Blue Gene,
so I'd like to check with the group before I jump in :-)</font><br>
<font face="Courier New, Courier" size=2> <br>
Thanks, Mike<br>
</font>_______________________________________________<br>
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---------------------------------<br>
Eric Jakobsson, Ph.D.<br>
Professor, Department of Molecular and Integrative Physiology, and of
Biochemistry, and of the Center for Biophysics and Computational
Biology<br>
Senior Research Scientist, National Center for Supercomputing
Applications<br>
Professor, Beckman Institute for Advanced Science and Technology<br>
3261 Beckman Institute, mc251<br>
University of Illinois, Urbana, IL 61801<br>
ph. 217-244-2896 Fax 217 244 9757 <br><br>
<br><br>
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