Unverified Commit b665514a authored by markuskowa's avatar markuskowa Committed by GitHub
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Merge pull request #290665 from markuskowa/fix-gromacs 

gromacs: fix CUDA build
parents bb84ac6f f6616d2e

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

+5 −0
Original line number Diff line number Diff line
@@ -19,6 +19,10 @@ 
, cpuAcceleration ? null

}:





# CUDA is only implemented for single precission

assert enableCuda -> singlePrec;



let

  inherit (cudaPackages.cudaFlags) cudaCapabilities dropDot;
@@ -75,6 +79,7 @@ in stdenv.mkDerivation rec { 
    lapack

  ] ++ lib.optional enableMpi mpi

  ++ lib.optionals enableCuda [

    cudaPackages.cuda_cccl

    cudaPackages.cuda_cudart

    cudaPackages.libcufft

    cudaPackages.cuda_profiler_api