CCL:FYI: superlinear speedups in GROMACS (fwd)
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Eugene Leitl Eugene.Leitl at lrz.uni-muenchen.deFri Mar 8 12:10:29 PST 2002
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-- Eugen* Leitl <a href="http://leitl.org">leitl</a> ______________________________________________________________ ICBMTO: N48 04'14.8'' E11 36'41.2'' http://www.leitl.org 57F9CFD3: ED90 0433 EB74 E4A9 537F CFF5 86E7 629B 57F9 CFD3 ---------- Forwarded message ---------- Date: Fri, 8 Mar 2002 13:28:37 -0600 (CST) From: Fred P. Arnold <fparnold at chem.northwestern.edu> To: Eugene Leitl <Eugene.Leitl at lrz.uni-muenchen.de> Cc: chemistry at ccl.net Subject: Re: CCL:FYI: superlinear speedups in GROMACS We saw benchmarks of GAMESS-US on the IBM SP2 years ago that did this. Same issue; eventually the pieces are small enough to fit into cache, and it takes off like a shot, as long as communication overhead doesn't begin to dominate the calculation. -Fred Frederick P. Arnold, Jr. NUIT, Northwestern U. f-arnold at northwestern.edu
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