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- Fri Sep 25, 2015 6:21 pm
- Forum: OpenMM
- Topic: OpenMM is too slow on Titan X on Sherlock
- Replies: 2
- Views: 248
OpenMM is too slow on Titan X on Sherlock
I've run a benchmark simulation of Dihydrofolate Reductase using one Titan X GPU (CUDA platform) on sherlock.stanford.edu. It gave me only 109 ns/day, in comparison to 174 ns/day reported here: http://wiki.simtk.org/openmm/BenchmarkOpenMMDHFR Specifically, I submitted the following job script: #!/bi...