CP2K Open Source Molecular Dynamics

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howto:libcusmm [2014/03/28 14:31] – oschuetthowto:libcusmm [2014/03/28 14:33] – oschuett
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 tune_8x8x8.job tune_8x8x8.job
 </code> </code>
-For each possible parameter-set a //launcher// is generated. A launcher is a small snipped of C code, which launches the kernel by using the cuda specific ''<<< >>>''-notation. It also instantiates the C++ template which contains the actual kernel code.+For each possible parameter-set a //launcher// is generated. A launcher is a small snipped of C code, which launches the kernel by using the cuda specific ''%%<<< >>>%%''-notation. It also instantiates the C++ template which contains the actual kernel code.
  
 In order to parallelize the benchmarking the launchers are distributed over multiple executables. In order to parallelize the benchmarking the launchers are distributed over multiple executables.
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 === Step 3: Submit Jobs === === Step 3: Submit Jobs ===
 Each tune-directory contains a job file. Each tune-directory contains a job file.
-Since, there might be many tune-directories the convince script ''submit.py'' can be used. It will go through all the ''tune_*''-directories and check if it has already been submited or run. For this the script calls ''squeue'' in the background and it searches for ''slurm-*.out'' files.+Since, there might be many tune-directories the convenience script ''submit.py'' can be used. It will go through all the ''tune_*''-directories and check if it has already been submited or run. For this the script calls ''squeue'' in the background and it searches for ''slurm-*.out'' files.
  
 When ''submit.py'' is called without arguments it will just list the jobs that could be submitted: When ''submit.py'' is called without arguments it will just list the jobs that could be submitted:
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 </code> </code>
  
-Only when ''submit.py'' is called with ''doit!'' as its first argument it will actually submit job:+Only when ''submit.py'' is called with ''doit!'' as its first argument it will actually submit jobs:
 <code> <code>
 $ ./submit.py doit! $ ./submit.py doit!