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author | Alyssa Ross <hi@alyssa.is> | 2021-06-22 15:01:47 +0000 |
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committer | Alyssa Ross <hi@alyssa.is> | 2021-06-22 16:57:59 +0000 |
commit | 633cab0ecb07627706c6b523e219490f019eaab5 (patch) | |
tree | 4fb472bdfe2723037dad53dc1b8a87c939015f5e /nixpkgs/pkgs/development/libraries/pcmsolver | |
parent | ffb691c199e7e0cbc4e45e5310779c9e3f7c2a73 (diff) | |
parent | 432fc2d9a67f92e05438dff5fdc2b39d33f77997 (diff) | |
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Merge commit '432fc2d9a67f92e05438dff5fdc2b39d33f77997'
# Conflicts: # nixpkgs/pkgs/applications/editors/emacs/elisp-packages/elpa-generated.nix # nixpkgs/pkgs/applications/networking/mailreaders/thunderbird/default.nix # nixpkgs/pkgs/applications/window-managers/sway/default.nix # nixpkgs/pkgs/build-support/rust/default.nix # nixpkgs/pkgs/development/go-modules/generic/default.nix
Diffstat (limited to 'nixpkgs/pkgs/development/libraries/pcmsolver')
-rw-r--r-- | nixpkgs/pkgs/development/libraries/pcmsolver/default.nix | 43 |
1 files changed, 43 insertions, 0 deletions
diff --git a/nixpkgs/pkgs/development/libraries/pcmsolver/default.nix b/nixpkgs/pkgs/development/libraries/pcmsolver/default.nix new file mode 100644 index 000000000000..8cd4b318cc5a --- /dev/null +++ b/nixpkgs/pkgs/development/libraries/pcmsolver/default.nix @@ -0,0 +1,43 @@ +{ lib, stdenv, fetchFromGitHub, cmake, perl, gfortran, python +, boost, eigen, zlib +} : + +stdenv.mkDerivation rec { + pname = "pcmsolver"; + version = "1.3.0"; + + src = fetchFromGitHub { + owner = "PCMSolver"; + repo = pname; + rev = "v${version}"; + sha256= "0jrxr8z21hjy7ik999hna9rdqy221kbkl3qkb06xw7g80rc9x9yr"; + }; + + nativeBuildInputs = [ + cmake + gfortran + perl + python + ]; + + buildInputs = [ + boost + eigen + zlib + ]; + + cmakeFlags = [ "-DENABLE_OPENMP=ON" ]; + + hardeningDisable = [ "format" ]; + + # Requires files, that are not installed. + doCheck = false; + + meta = with lib; { + description = "An API for the Polarizable Continuum Model"; + homepage = "https://pcmsolver.readthedocs.io/en/stable/"; + license = licenses.lgpl3Only; + platforms = platforms.linux; + maintainers = [ maintainers.sheepforce ]; + }; +} |