Unverified Commit 48c81e46 authored by Weijia Wang's avatar Weijia Wang Committed by GitHub
Browse files

Merge pull request #285772 from markuskowa/fix-gromacs 

gromacs: fix build on Darwin, add OpenMP for Darwin
parents 11ef076a 13eb3a2a

pkgs/applications/science/molecular-dynamics/gromacs/default.nix

+2 −1
Original line number Diff line number Diff line
@@ -7,6 +7,7 @@ 
, perl

, blas

, lapack

, llvmPackages

, mpi

, cudaPackages

, plumed
@@ -77,7 +78,7 @@ in stdenv.mkDerivation rec { 
    cudaPackages.cuda_cudart

    cudaPackages.libcufft

    cudaPackages.cuda_profiler_api

  ];

  ] ++ lib.optional stdenv.isDarwin llvmPackages.openmp;



  propagatedBuildInputs = lib.optional enableMpi mpi;

  propagatedUserEnvPkgs = lib.optional enableMpi mpi;