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Compiling HOOMD-blue in RHEL/CentOS

This documentation was written and tested in RHEL/CentOS 6.5. It may not work for other versions.

Development environment

  1. Follow NVIDIA's instructions to install the NVIDIA CUDA rpm repository.
  2. Follow Fedora's instructions to install the EPEL repository.
  3. Install g++, boost, python headers, zlib headers, git, cmake, openmpi, and CUDA.
    1 $ sudo yum install gcc-c++ boost boost-devel python-devel zlib-devel git-all cmake openmpi openmpi-devel cuda

Compile hoomd

See Compile HOOMD-blue for instructions on compiling hoomd.