[gmx-users] installation

Rongliang Wu wurl04 at iccas.ac.cn
Wed Dec 28 10:37:11 CET 2005

Hello gmx-users,
   when configure with the commands: ./configure --prefix=/export/home/wurl/fftw --enable-threads
   i get at the end of confifure:
  Seems you are compiling with MPI support. You can install the MPI-
  enabled programs with suffixed names to have both MPI and non-MPI
  versions. This is useful e.g. on supercomputers where you usually
  cannot run MPI-linked programs on the login node.
  Set a suffix with e.g. --program-suffix=_mpi (or _mpi_d for double).
  You only need MPI for mdrun, so if you already have non-MPI stuff
  installed you can issue make mdrun; make install-mdrun.
  i don't know whether this will install parallel version, does it mean it cannot find the mpi in my computer? 



Rongliang Wu
State Key Laboratory
of Polymer Physics and Chemistry
Center of Molecular Science
Institute of Chemistry
Chinese Academy of Sciences

          wurl04 at iccas.ac.cn

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