Gromacs

Roadmap

    Table of contents
    1. 1. GROMACS 4.5.6
    2. 2. GROMACS 4.6
    3. 3. GROMACS 5.0

    GROMACS 4.5.6

    • Include cleared bug reports

    GROMACS 4.6

    Several important performance improvements, a few new features, for details look here.

    GROMACS 5.0

    • C++ default
    • CMake is required, automake - removed
    • CTest/CDash/CPack for testing and packaging
    • Doxygen documentation, cleanup
    • Test suite to assure that old features don't break when new are added
    • Benchmarking suite
    • GPU development
    Page last modified 15:07, 22 Sep 2011 by rossen