Thank you, Scott, your solution works. How does it affect the simulation?
What I did was
sed -i 's[gpu->sim.randomSteps =
MAX_RANDOM_STEPS;[gpu->sim.randomSteps = MAX_RANDOM_STEPS / 4;[g'
$AMBERHOME/src/pmemd/src/cuda/gpu.cpp
2011/8/22 Scott Le Grand <varelse2005.gmail.com>
> Yes, try dividing by 4 on a 1 GB card. It ought to get just enough room...
>
--
Sincerely,
Dmitry Mukha
Institute of Bioorganic Chemistry, NAS, Minsk, Belarus
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Received on Tue Aug 23 2011 - 07:00:03 PDT
