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16 lines
4.6 KiB
16 lines
4.6 KiB
BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0 ) hwloc? ( sys-apps/hwloc ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_7? ( dev-lang/python:3.7 >=dev-lang/python-exec-2:=[python_targets_python3_7] ) python_single_target_python3_8? ( dev-lang/python:3.8 >=dev-lang/python-exec-2:=[python_targets_python3_8] ) python_single_target_python3_9? ( dev-lang/python:3.9 >=dev-lang/python-exec-2:=[python_targets_python3_9] ) !sci-chemistry/gmxapi virtual/pkgconfig doc? ( app-doc/doxygen python_single_target_python3_7? ( dev-python/sphinx[python_targets_python3_7(-)] ) python_single_target_python3_8? ( dev-python/sphinx[python_targets_python3_8(-)] ) python_single_target_python3_9? ( dev-python/sphinx[python_targets_python3_9(-)] ) media-gfx/mscgen media-gfx/graphviz dev-texlive/texlive-latex dev-texlive/texlive-latexextra media-gfx/imagemagick ) dev-util/ninja dev-util/cmake python_single_target_python3_7? ( dev-lang/python:3.7 >=dev-lang/python-exec-2:=[python_targets_python3_7] ) python_single_target_python3_8? ( dev-lang/python:3.8 >=dev-lang/python-exec-2:=[python_targets_python3_8] ) python_single_target_python3_9? ( dev-lang/python:3.9 >=dev-lang/python-exec-2:=[python_targets_python3_9] ) python_single_target_python3_7? ( >=dev-python/setuptools-42.0.2[python_targets_python3_7(-)] ) python_single_target_python3_8? ( >=dev-python/setuptools-42.0.2[python_targets_python3_8(-)] ) python_single_target_python3_9? ( >=dev-python/setuptools-42.0.2[python_targets_python3_9(-)] )
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DEFINED_PHASES=compile configure install postinst prepare pretend setup test unpack
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DESCRIPTION=The ultimate molecular dynamics simulation package
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EAPI=7
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HOMEPAGE=http://www.gromacs.org/
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IUSE=X blas cuda +custom-cflags +doc -double-precision +fftw +gmxapi +gmxapi-legacy +hwloc lapack +lmfit mkl mpi +offensive opencl openmp +python +single-precision test +threads +tng cpu_flags_x86_sse2 cpu_flags_x86_sse4_1 cpu_flags_x86_fma4 cpu_flags_x86_avx cpu_flags_x86_avx2 python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9
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KEYWORDS=~amd64 ~arm ~x86 ~amd64-linux ~x86-linux ~x64-macos
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LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD )
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RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-6.5.14 ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0 ) hwloc? ( sys-apps/hwloc ) lapack? ( virtual/lapack ) lmfit? ( sci-libs/lmfit ) mkl? ( sci-libs/mkl ) mpi? ( virtual/mpi ) python_single_target_python3_7? ( dev-lang/python:3.7 >=dev-lang/python-exec-2:=[python_targets_python3_7] ) python_single_target_python3_8? ( dev-lang/python:3.8 >=dev-lang/python-exec-2:=[python_targets_python3_8] ) python_single_target_python3_9? ( dev-lang/python:3.9 >=dev-lang/python-exec-2:=[python_targets_python3_9] ) !sci-chemistry/gmxapi python_single_target_python3_7? ( dev-lang/python:3.7 >=dev-lang/python-exec-2:=[python_targets_python3_7] ) python_single_target_python3_8? ( dev-lang/python:3.8 >=dev-lang/python-exec-2:=[python_targets_python3_8] ) python_single_target_python3_9? ( dev-lang/python:3.9 >=dev-lang/python-exec-2:=[python_targets_python3_9] )
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REQUIRED_USE=|| ( single-precision double-precision ) cuda? ( single-precision ) cuda? ( !opencl ) mkl? ( !blas !fftw !lapack ) ^^ ( python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 ) ^^ ( python_single_target_python3_7 python_single_target_python3_8 python_single_target_python3_9 )
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RESTRICT=!test? ( test )
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SLOT=0/2020.5
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SRC_URI=http://ftp.gromacs.org/gromacs/gromacs-2020.5.tar.gz test? ( http://ftp.gromacs.org/regressiontests/regressiontests-2020.5.tar.gz )
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_eclasses_=bash-completion-r1 8e7c071081c68c2c398b77fe3a1d6908 cmake 518e4c9a6a38dfd7afc54b6a7c5de3da cuda c2f1b334711bbbf2130f339636dc7515 distutils-r1 f0ca511df3fddd316b783632b804e8fb edos2unix 33e347e171066657f91f8b0c72ec8773 eutils 2d5b3f4b315094768576b6799e4f926e flag-o-matic c0964e43ba712cb933da5f65b958fa88 l10n 8cdd85e169b835d518bc2fd59f780d8e multilib d410501a125f99ffb560b0c523cd3d1e multiprocessing cac3169468f893670dac3e7cb940e045 ninja-utils 132cbb376048d079b5a012f5467c4e7f python-single-r1 d25ac9d5d91fe9d44fda6ec192aca11a python-utils-r1 20c4a380a6193a089c8c432f3e5f8402 readme.gentoo-r1 22ae82e140bdd95d17a34fd5fd733190 toolchain-funcs 24921b57d6561d87cbef4916a296ada4 wrapper 4251d4c84c25f59094fd557e0063a974 xdg-utils ff2ff954e6b17929574eee4efc5152ba
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_md5_=905da1814b7d5aa72dd6a76199482601
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