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gromacs: update to 2016.5
Notice that gromacs-plumed patch is done on gromacs 2016.4. However,
the two patches are compatible, so patch for 2016.4 can be used on 2016.5.
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science/gromacs/Portfile
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@@ -11,7 +11,7 @@ PortGroup linear_algebra 1.0 |
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name gromacs |
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# not all versions have patches available for plumed; subport's patch will fail if not there |
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version 2016.4 |
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version 2016.5 |
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revision 1 |
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categories science math |
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license LGPL-2.1 |
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@@ -31,9 +31,9 @@ homepage http://www.gromacs.org/ |
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master_sites http://ftp.gromacs.org/pub/gromacs |
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# md5 published at http://www.gromacs.org/Downloads |
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checksums rmd160 76d85579ae322ef61e7382984e66f48f63d1cba9 \ |
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sha256 4be9d3bfda0bdf3b5c53041e0b8344f7d22b75128759d9bfa9442fe65c289264 \ |
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md5 19c8b5c85f3ec62df79d2249a3c272f8 |
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checksums rmd160 10d8808e8c5b04702d83f385f78c0d9effdfa266 \ |
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sha256 57db26c6d9af84710a1e0c47a1f5bf63a22641456448dcd2eeb556ebd14e0b7c \ |
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md5 f41807e5b2911ccb547a3fd11f105d47 |
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depends_build-append \ |
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port:pkgconfig |
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@@ -113,7 +113,7 @@ subport gromacs-plumed { |
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# override the choice setting the PLUMED_KERNEL environment variable. |
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# Also notice that gromacs version is hardcoded here. Plumed patch is not always |
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# updated when gromacs is. |
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exec ${prefix}/bin/plumed patch --mdroot=${worksrcpath} -e gromacs-${version} --runtime -p |
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exec ${prefix}/bin/plumed patch --mdroot=${worksrcpath} -e gromacs-2016.4 --runtime -p |
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} |
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notes " |
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PLUMED is linked with runtime binding. By setting the environment variable PLUMED_KERNEL\ |
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