I just noticed that one of my systems was running FAHCore_82 and a p1800_Collagen_PPG10_restrained_unfolding. Anybody else got these? 🙂
Update, on an 800MHz AMD Duron:
AMBER: p1800_Collagen_PPG10_restrained_unfolding 77 points, 46 PPD
GROMACS: p1275_proj1275_A21ext_d19_99phi 46 points, 16 PPD
Notice the big difference! I hypothesize that Gromacs doesn't do as well when it doesn't have SSE, but I really don't know. We'll have to wait for a Tinker to hit that box before I can have a complete comparison, because I'm not going to give up points by turning off Big WUs on my one system that can handle them... 😉
Update, on an 800MHz AMD Duron:
AMBER: p1800_Collagen_PPG10_restrained_unfolding 77 points, 46 PPD
GROMACS: p1275_proj1275_A21ext_d19_99phi 46 points, 16 PPD
Notice the big difference! I hypothesize that Gromacs doesn't do as well when it doesn't have SSE, but I really don't know. We'll have to wait for a Tinker to hit that box before I can have a complete comparison, because I'm not going to give up points by turning off Big WUs on my one system that can handle them... 😉