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modified: g/GROMACS/GROMACS-2016.5-intel-2017b-serial.eb

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modified:   g/GROMACS/GROMACS-2018-intel-2017b-serial.eb
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Lukáš Krupčík 2018-02-20 15:46:03 +01:00
parent 2673cd3a00
commit f0cb3c98a1
2 changed files with 5 additions and 2 deletions
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g/GROMACS/GROMACS-2016.5-intel-2017b-serial.eb
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@ -13,7 +13,9 @@ sources = [SOURCELOWER_TAR_GZ]
checksums = ['f41807e5b2911ccb547a3fd11f105d47']
configopts = ' -DGMX_GPU=OFF -DBUILD_SHARED_LIBS=OFF -DGMX_PREFER_STATIC_LIBS=ON -DGMX_DOUBLE=OFF -DGMX_SIMD=AVX2_256 -DGMX_BUILD_OWN_FFTW=ON -DGMX_MPI=ON'
#configopts = ' -DGMX_GPU=OFF -DBUILD_SHARED_LIBS=OFF -DGMX_PREFER_STATIC_LIBS=ON -DGMX_DOUBLE=OFF -DGMX_SIMD=AVX2_256 -DGMX_BUILD_OWN_FFTW=ON -DGMX_MPI=ON'
# anselm
configopts = ' -DGMX_GPU=OFF -DBUILD_SHARED_LIBS=OFF -DGMX_PREFER_STATIC_LIBS=ON -DGMX_DOUBLE=OFF -DGMX_SIMD=SSE4.1 -DGMX_BUILD_OWN_FFTW=ON -DGMX_MPI=ON'
builddependencies = [
('CMake', '3.9.1', '', True),

3
g/GROMACS/GROMACS-2018-intel-2017b-serial.eb
View File

@ -13,7 +13,8 @@ sources = [SOURCELOWER_TAR_GZ]
checksums = ['6467ffb1575b8271548a13abfba6374c']
configopts = ' -DGMX_GPU=OFF -DBUILD_SHARED_LIBS=OFF -DGMX_PREFER_STATIC_LIBS=ON -DGMX_DOUBLE=OFF -DGMX_SIMD=AVX2_256 -DGMX_BUILD_OWN_FFTW=ON -DGMX_MPI=ON'
#configopts = ' -DGMX_GPU=OFF -DBUILD_SHARED_LIBS=OFF -DGMX_PREFER_STATIC_LIBS=ON -DGMX_DOUBLE=OFF -DGMX_SIMD=AVX2_256 -DGMX_BUILD_OWN_FFTW=ON -DGMX_MPI=ON'
configopts = ' -DGMX_GPU=OFF -DBUILD_SHARED_LIBS=OFF -DGMX_PREFER_STATIC_LIBS=ON -DGMX_DOUBLE=OFF -DGMX_SIMD=AUTO -DGMX_BUILD_OWN_FFTW=ON -DGMX_MPI=ON'
builddependencies = [
('CMake', '3.9.1', '', True),