[gmx-users] the code speed between Gromacs 3.0 and Gromacs 4.0
li.dc06 at gmail.com
Tue Dec 29 04:05:42 CET 2009
Are there any comparisons of the code speed between Gromacs 3.0 and Gromacs 4.0. In my calculation, I got a speed about 3.5ns/day of a system have about 50,000 atoms, using 8 CPUs with Gromacs 3.3.1. In contrast, the speed can reach up to 7.3ns/day when switch to Gromacs 4.0.7 while the other conditions are keep the same. Is this result normal?
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