Difference between revisions of "Benchmarking: NAMD 2.10"

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== Build from source ==
 
== Build from source ==
  
# Unpack NAMD and matching Charm++ source code:
+
# Unpack NAMD and matching Charm++ source code: <syntaxhighlight>tar xzf NAMD_2.10_Source.tar.gz
tar xzf NAMD_2.10_Source.tar.gz
 
 
  cd NAMD_2.10_Source
 
  cd NAMD_2.10_Source
 
  tar xf charm-6.6.1.tar
 
  tar xf charm-6.6.1.tar
 
+
</syntaxhighlight>
 
# Build and test the Charm++/Converse library (multicore version):
 
# Build and test the Charm++/Converse library (multicore version):
 
  cd charm-6.6.1
 
  cd charm-6.6.1

Revision as of 17:27, 7 January 2015

Download NAMD 2.10

Download NAMD 2.10 source code or prebuilt binaries from: http://www.ks.uiuc.edu/Development/Download/download.cgi?PackageName=NAMD

Build from source

  1. Unpack NAMD and matching Charm++ source code:
    tar xzf NAMD_2.10_Source.tar.gz
     cd NAMD_2.10_Source
     tar xf charm-6.6.1.tar
  2. Build and test the Charm++/Converse library (multicore version):
cd charm-6.6.1
./build charm++ multicore-linux64 --with-production
cd multicore-linux64/tests/charm++/megatest
make pgm
./pgm +p4   (multicore does not support multiple nodes)
cd ../../../../..