diff options
Diffstat (limited to 'nixpkgs/pkgs/development/libraries/science/chemistry/plumed/default.nix')
-rw-r--r-- | nixpkgs/pkgs/development/libraries/science/chemistry/plumed/default.nix | 34 |
1 files changed, 34 insertions, 0 deletions
diff --git a/nixpkgs/pkgs/development/libraries/science/chemistry/plumed/default.nix b/nixpkgs/pkgs/development/libraries/science/chemistry/plumed/default.nix new file mode 100644 index 000000000000..b825c8270d62 --- /dev/null +++ b/nixpkgs/pkgs/development/libraries/science/chemistry/plumed/default.nix @@ -0,0 +1,34 @@ +{ stdenv +, lib +, fetchFromGitHub +, blas +}: + +assert !blas.isILP64; + +stdenv.mkDerivation rec { + pname = "plumed"; + version = "2.9.0"; + + src = fetchFromGitHub { + owner = "plumed"; + repo = "plumed2"; + rev = "v${version}"; + hash = "sha256-yL+59f908IhbxGIylI1ydi1BPZwAapjK/vP4/h5gcHk="; + }; + + postPatch = '' + patchShebangs . + ''; + + buildInputs = [ blas ]; + + enableParallelBuilding = true; + + meta = with lib; { + description = "Molecular metadynamics library"; + homepage = "https://github.com/plumed/plumed2"; + license = licenses.lgpl3Only; + maintainers = [ maintainers.sheepforce ]; + }; +} |