Package gromacs: Information

    Source package: gromacs
    Version: 4.0.7-alt8
    Build time:  Aug 12, 2012, 12:18 AM
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    License: GPL
    Summary: Molecular dynamics package
    Description: 
    GROMACS is a versatile and extremely well optimized package
    to perform molecular dynamics computer simulations and
    subsequent trajectory analysis. It is developed for
    biomolecules like proteins, but the extremely high
    performance means it is used also in several other field
    like polymer chemistry and solid state physics.
    
    This package provides single and double precision binaries.
    The documentation is in the package gromacs-common.
    
    N.B. All binaries have names starting with g_, for example
    mdrun has been renamed to g_mdrun.

    List of rpms provided by this srpm:
    gromacs (x86_64, i586)
    gromacs-common (noarch)
    gromacs-debuginfo (x86_64, i586)
    gromacs-devel (x86_64, i586)
    gromacs-doc (noarch)
    gromacs-libs (x86_64, i586)
    gromacs-libs-debuginfo (x86_64, i586)
    gromacs-mpi (x86_64, i586)
    gromacs-mpi-debuginfo (x86_64, i586)
    gromacs-mpi-devel (x86_64, i586)
    gromacs-mpi-libs (x86_64, i586)
    gromacs-mpi-libs-debuginfo (x86_64, i586)
    gromacs-shell-extensions (x86_64, i586)
    gromacs-tutor (noarch)

    Maintainer: Michael Shigorin


    ACL:
    Michael Shigorin
    @qa
    @everybody

      1. libopenmotif-devel
      2. imake
      3. libSM-devel
      4. libgsl-devel
      5. libX11-devel
      6. gcc-fortran
      7. libtool_1.5
      8. openmpi-devel
      9. libfftw3-devel >= 3.0.1
      10. xorg-cf-files
      11. chrpath
      12. liblapack-devel

    Last changed


    Aug. 11, 2012 Eugeny A. Rostovtsev 4.0.7-alt8
    - Built with OpenBLAS instead of GotoBLAS2
    July 5, 2012 Eugeny A. Rostovtsev 4.0.7-alt7
    - Rebuilt with OpenMPI 1.6
    Feb. 4, 2012 Eugeny A. Rostovtsev 4.0.7-alt6
    - Fixed RPATH