BDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1:= ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? ( =dev-util/cmake-3.20.5 DEFINED_PHASES=compile configure install postinst prepare pretend setup test DESCRIPTION=The ultimate molecular dynamics simulation package EAPI=7 HOMEPAGE=https://www.gromacs.org/ INHERIT=bash-completion-r1 cmake cuda readme.gentoo-r1 toolchain-funcs xdg-utils IUSE=X blas cuda +doc double-precision +fftw +hwloc lapack mkl mpi +offensive opencl openmp +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 KEYWORDS=amd64 arm ~x86 ~amd64-linux ~x86-linux ~x64-macos LICENSE=LGPL-2.1 UoI-NCSA !mkl? ( !fftw? ( BSD ) !blas? ( BSD ) !lapack? ( BSD ) ) cuda? ( LGPL-3 ) threads? ( BSD ) RDEPEND=X? ( x11-libs/libX11 x11-libs/libSM x11-libs/libICE ) blas? ( virtual/blas ) cuda? ( >=dev-util/nvidia-cuda-toolkit-4.2.9-r1:= ) opencl? ( virtual/opencl ) fftw? ( sci-libs/fftw:3.0= ) hwloc? (