Difference between revisions of "Benchmarking: NAMD 2.10"

From Define Wiki
Jump to navigation Jump to search
Line 6: Line 6:
  
 
# Unpack NAMD and matching Charm++ source code: <syntaxhighlight>tar xzf NAMD_2.10_Source.tar.gz
 
# Unpack NAMD and matching Charm++ source code: <syntaxhighlight>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>
 
</syntaxhighlight>
 
# Build and test the Charm++/Converse library (multicore version):
 
# Build and test the Charm++/Converse library (multicore version):

Revision as of 17:28, 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 ../../../../..