diff --git a/pkgs/development/python-modules/atsim_potentials/default.nix b/pkgs/development/python-modules/atsim_potentials/default.nix new file mode 100644 index 00000000000..5d664e77d29 --- /dev/null +++ b/pkgs/development/python-modules/atsim_potentials/default.nix @@ -0,0 +1,33 @@ +{ stdenv +, buildPythonPackage +, fetchPypi +, pytest +, future +}: + +buildPythonPackage rec { + version = "0.2.1"; + pname = "atsim.potentials"; + + src = fetchPypi { + inherit pname version; + sha256 = "2abdec2fb4e8198f4e0e41634ad86625d5356a4a3f1ba1f41568d0697df8f36f"; + }; + + checkInputs = [ pytest ]; + propagatedBuildInputs = [ future ]; + + # tests are not included with release + doCheck = false; + + checkPhase = '' + py.test + ''; + + meta = with stdenv.lib; { + homepage = https://bitbucket.org/mjdr/atsim_potentials; + description = "Provides tools for working with pair and embedded atom method potential models including tabulation routines for DL_POLY and LAMMPS"; + license = licenses.mit; + maintainers = [ maintainers.costrouc ]; + }; +} diff --git a/pkgs/top-level/python-packages.nix b/pkgs/top-level/python-packages.nix index 62b77b187bc..2bea7b3053b 100644 --- a/pkgs/top-level/python-packages.nix +++ b/pkgs/top-level/python-packages.nix @@ -745,6 +745,8 @@ in { attrs = callPackage ../development/python-modules/attrs { }; + atsim_potentials = callPackage ../development/python-modules/atsim_potentials { }; + audioread = callPackage ../development/python-modules/audioread { }; audiotools = callPackage ../development/python-modules/audiotools { };