portage-ng / portage / sci-chemistry / gromacs / 2024.6
portage-ng --info
>>> Printing information for: portage://sci-chemistry/gromacs-2024.6


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description : 
   The ultimate molecular dynamics simulation package
homepage : 
   https://www.gromacs.org/
maintainer : 
   alexxy@gentoo.org
   sci-chemistry@gentoo.org
license : 
   LGPL-2.1
   UoI-NCSA
   use -mkl
      use -fftw
         BSD
      use -blas
         BSD
      use -lapack
         BSD
   use cuda
      LGPL-3
   use threads
      BSD
eapi : 
   8
slot : 
   0
subslot : 
   2024.6

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iuse : 
   blas
   clang
   clang-cuda
   cuda
   +custom-cflags
   +doc
   build-manual
   double-precision
   +fftw
   +gmxapi
   +gmxapi-legacy
   +hwloc
   lapack
   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
   cpu_flags_x86_avx512f
   cpu_flags_arm_neon
   python_single_target_python3_12
   python_single_target_python3_13
   python_single_target_python3_14
required_use : 
   any 
      single-precision
      double-precision
   use doc
      !build-manual
   use cuda
      single-precision
   use opencl
      single-precision
   use cuda
      !opencl
   use clang-cuda
      clang
      cuda
   use mkl
      !blas
      !fftw
      !lapack
   one 
      python_single_target_python3_12
      python_single_target_python3_13
      python_single_target_python3_14
keywords : 
   stable(amd64)
   broken(arm)
   stable(arm64)
   unstable(riscv)
   broken(x86)
   unstable(x64-macos)
properties : 
   [not set]
eclasses : 
   toolchain-funcs
   shell-completion
   bash-completion-r1
   flag-o-matic
   multiprocessing
   ninja-utils
   xdg-utils
   cmake
   cuda
   eapi9-pipestatus
   out-of-source-utils
   multibuild
   multilib
   python-utils-r1
   python-single-r1
   distutils-r1
   readme.gentoo-r1
defined_phases : 
   compile
   configure
   install
   postinst
   prepare
   pretend
   setup
   test
   unpack
installed : 
   [not set]

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src_uri : 
   gromacs-2024.6.tar.gz
   use doc
      manual-2024.6.pdf
   use test
      regressiontests-2024.6.tar.gz

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bdepend : 
   use blas
      virtual/blas
   use cuda
      >=dev-util/nvidia-cuda-toolkit-11:= [ profiler ]
   use opencl
      virtual/opencl
   use openmp
      any 
         sys-devel/gcc [ openmp ]
         llvm-runtimes/clang-runtime [ openmp ]
   use fftw
      sci-libs/fftw:3.0=
   use hwloc
      sys-apps/hwloc:=
   use lapack
      virtual/lapack
   use mkl
      sci-libs/mkl
   use mpi
      virtual/mpi [ cxx ]
   sci-libs/lmfit:=
   >=dev-cpp/muParser-2.3:=
   use python_single_target_python3_12
      dev-lang/python:3.12
   use python_single_target_python3_13
      dev-lang/python:3.13
   use python_single_target_python3_14
      dev-lang/python:3.14
   virtual/pkgconfig
   use clang
      >=llvm-core/clang-6:*
   use build-manual
      app-text/doxygen
      use python_single_target_python3_12
         dev-python/sphinx [ python_targets_python3_12(-) ]
         dev-python/sphinx-copybutton [ python_targets_python3_12(-) ]
         dev-python/sphinx-inline-tabs [ python_targets_python3_12(-) ]
         dev-python/sphinx-argparse [ python_targets_python3_12(-) ]
         dev-python/sphinxcontrib-autoprogram [ python_targets_python3_12(-) ]
      use python_single_target_python3_13
         dev-python/sphinx [ python_targets_python3_13(-) ]
         dev-python/sphinx-copybutton [ python_targets_python3_13(-) ]
         dev-python/sphinx-inline-tabs [ python_targets_python3_13(-) ]
         dev-python/sphinx-argparse [ python_targets_python3_13(-) ]
         dev-python/sphinxcontrib-autoprogram [ python_targets_python3_13(-) ]
      use python_single_target_python3_14
         dev-python/sphinx [ python_targets_python3_14(-) ]
         dev-python/sphinx-copybutton [ python_targets_python3_14(-) ]
         dev-python/sphinx-inline-tabs [ python_targets_python3_14(-) ]
         dev-python/sphinx-argparse [ python_targets_python3_14(-) ]
         dev-python/sphinxcontrib-autoprogram [ python_targets_python3_14(-) ]
      media-gfx/mscgen
      media-gfx/graphviz
      dev-texlive/texlive-latex
      dev-texlive/texlive-latexextra
      media-gfx/imagemagick
   app-alternatives/ninja
   >=dev-build/cmake-3.28.5

depend : 
   [not set]

idepend : 
   [not set]

rdepend : 
   use blas
      virtual/blas
   use cuda
      >=dev-util/nvidia-cuda-toolkit-11:= [ profiler ]
   use opencl
      virtual/opencl
   use openmp
      any 
         sys-devel/gcc [ openmp ]
         llvm-runtimes/clang-runtime [ openmp ]
   use fftw
      sci-libs/fftw:3.0=
   use hwloc
      sys-apps/hwloc:=
   use lapack
      virtual/lapack
   use mkl
      sci-libs/mkl
   use mpi
      virtual/mpi [ cxx ]
   sci-libs/lmfit:=
   >=dev-cpp/muParser-2.3:=
   use python_single_target_python3_12
      dev-lang/python:3.12
   use python_single_target_python3_13
      dev-lang/python:3.13
   use python_single_target_python3_14
      dev-lang/python:3.14

pdepend : 
   [not set]