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    The most recent release of the source code can be found at the top of this table, for which there are installation instructions. If you need an earlier version not listed here, contact the GROMACS crew. If you prefer to live on the cutting edge, and don't mind testing for correctness yourself, we also provide git repositories of the latest sources.


    If you have an older (pre-4.0-release) Gromacs version installed from source in the same location you should remove it before reinstalling. To adhere to modern Linux standards we have changed some subdirectories, and if you just install over the older files you risk ending up with duplicate files and data (RPMs take care of this automatically, though).

    To determine whether you need to upgrade you should check our list of revision changes.

     

    GROMACS 4.6 releases

    Source Release date MD5-sum
    gromacs-4.6.1.tar.gz 2013-03-05 a2a7952ec5566fe4b470285dbe5818e8
    gromacs-4.6.tar.gz 2013-01-19 d920a57884961a9fcbdcd9953ade469b
    gromacs-4.6-beta3.tar.gz 2012-12-22 b6280194172d3bc841210a97b00edc4d
    gromacs-4.6-beta2.tar.gz 2012-12-06 e2c393e6183a40fa734d150800c7e163
    gromacs-4.6-beta1.tar.gz 2012-11-30 39b2e26fdca756f91ce98246e8c079f2

     

     

     

     

    GROMACS 4.5.x and earlier releases

    gromacs-4.5.7.tar.gz 2013-04-29 24febafaf51be785b1c755ef679bea08
    gromacs-4.5.7-broken-configure.tar.gz 2013-04-19 d6e4ca9aa87292feca713804ce871b9d
    gromacs-4.5.6.tar.gz 2013-01-19 ad7405f8e04df5912ecf89d517ce86f6
    gromacs-4.5.5.tar.gz 2011-10-20 6a87e7cdfb25d81afa9fea073eb28468
    gromacs-4.5.4.tar.gz 2011-03-21 5013de941017e014b92d41f82c7e86d6
    gromacs-4.5.3.tar.gz 2010-11-09 d5911585cd0e0b996dbbdcfb4c3bcf6b
    gromacs-4.5.2.tar.gz 2010-10-30 3d74c7b363a3b124e48424375b49ce67
    gromacs-4.5.1.tar.gz 2010-09-02 d4b737b0bea8a9390d2c3ad9b159914d
    gromacs-4.5.tar.gz 2010-09-01 2e9a1e1c35a74fec3486d4f8f9e0b974
    gromacs-4.0.7.tar.gz 2009-12-06 51369bd553e6bba4085a58bcf23d337d
    gromacs-4.0.6.tar.gz 2009-12-06 a903b9b0a87f941a5ce9c59d1529b2d2
    gromacs-4.0.5.tar.gz 2009-05-09 2db2261852a4d3a97547979f379dee94
    gromacs-4.0.4.tar.gz 2009-02-17 5ae66b152c634ccfde2c57c81266d1fd
    gromacs-4.0.3.tar.gz 2009-01-18 2902403671a0f9b0934ddf3ca586b7ec
    gromacs-4.0.2.tar.gz 2008-11-09 7a9eedf9ef365d32cd01355b8950ddc5
    gromacs-4.0.tar.gz 2008-10-10 bfc18a2ecc998f542438316b9148b7ff
    gromacs-3.3.4.tar.gz 2009-07-29 dd1b9bd4b8c2bf4447b9fe6fb7937725
    gromacs-3.3.3.tar.gz 2008-02-29 33f5f434d69b45bc51c5af36f5719618
    gromacs-3.3.2.tar.gz 2007-09-28 f25853fefdbfbe7f4e8667a16c495736
    gromacs-3.3.1.tar.gz 2006-04-06 1af34a99950813ca7cf893253c447cd1
    gromacs-3.3.tar.gz 2005-10-10 99ea6f25a89f1511f51c350a66a2fdc4
    gromacs-3.2.1.tar.gz 2004-03-01 d298386495f6ee39b3155ce951984485
    gromacs-3.2.tar.gz 2004-01-26 b7b1ec42f0207794bb3a24fef541f3f5
    gromacs-3.1.4.tar.gz 2002-06-13 835247417207a9852583a78f835a7da2
    gromacs-3.1.3.tar.gz 2002-04-13 6e6a167075d1138e0cf98601a8f0608b
    gromacs-3.1.2.tar.gz 2002-04-02 1492d8d05f7dda213d7fedfe3d0a88bd
    gromacs-3.1.1.tar.gz 2002-03-07 0b8d06381548f5b8ad94000987633ad6
    gromacs-3.1.tar.gz 2002-03-01 21405de108634abcb0f596031e6b44d3
    gromacs-3.0.5.tar.gz 2001-10-26 200c3efd3cc3b9923284886f21121727
    gromacs-3.0.4.tar.gz 2001-10-24 4a74e5723b4237d50cfdb8b098935a0b
    gromacs-3.0.3.tar.gz 2001-08-30 8c5543b9f3d45a9889aaf6c2fdc1d496
    gromacs-3.0.2.tar.gz 2001-08-27 dfc8bee40977fd880436610da30b0f71
    gromacs-3.0.1.tar.gz 2001-08-18 a5b9262dbfcdcbfc110bbcfd29a19926
    gromacs-3.0.tar.gz 2001-08-11 6c2a19205c46f9857748be2c006e8a34

    You can use the MD5 sum in the table to check the integrity of the file when you have downloaded it - run the 'md5sum' program on your file and compare with the value in the table. Note that web browsers sometimes uncompress files on the fly when you download them.

     

    Regressiontests

    Only available for 4.6 releases - use the version with matching number

    Source Release date md5
    regressiontests-4.6.1.tar.gz 2013-04-05 0b648a4fc431777d746bf78313d33bf5
    regressiontests-4.6.tar.gz 2013-01-18 c4e150e70eccd7bba4601868ac307659

     

    Other useful program codes:

     

    Source Release date md5
    xdrfile-1.1.1.tar.gz 2011-04-08 1ceb84765ec212a6f709faf559649023

    xdrfile-1.1.tar.gz

    		 2009-05-19 529605c4348d4a7352f9bdb54267923c
    xdrfile-1.0.tar.gz 2009-04-03 c7fe194e524f371adc6bc1c86b739bea

     


     


     


     


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    Page last modified 15:35, 29 Apr 2013 by mabraham