Unverified Commit 79e6c758 authored by Nick Cao's avatar Nick Cao
Browse files

python312Packages.sumo: modernize

parent c7922e78

pkgs/development/python-modules/sumo/default.nix

+27 −21
Original line number Diff line number Diff line
@@ -3,24 +3,25 @@ 
  buildPythonPackage,

  fetchFromGitHub,

  pythonOlder,

  cython,

  h5py,

  matplotlib,

  setuptools,

  spglib,

  numpy,

  phonopy,

  pymatgen,

  scipy,

  h5py,

  pymatgen,

  phonopy,

  matplotlib,

  seekpath,

  spglib,

  castepxbin,

  pytestCheckHook,

  colormath,

  importlib-resources,

  pytestCheckHook,

}:



buildPythonPackage rec {

  pname = "sumo";

  version = "2.3.10";

  format = "setuptools";

  pyproject = true;



  disabled = pythonOlder "3.8";
@@ -31,30 +32,35 @@ buildPythonPackage rec { 
    hash = "sha256-WoOW+JPo5x9V6LN+e8Vf3Q3ohHhQVK81s0Qk7oPn1Tk=";

  };



  nativeBuildInputs = [ cython ];

  build-system = [

    setuptools

  ];



  propagatedBuildInputs = [

    castepxbin

    colormath

    h5py

    matplotlib

  dependencies = [

    spglib

    numpy

    phonopy

    pymatgen

    scipy

    h5py

    pymatgen

    phonopy

    matplotlib

    seekpath

    spglib

    castepxbin

    colormath

    importlib-resources

  ];



  nativeCheckInputs = [ pytestCheckHook ];

  nativeCheckInputs = [

    pytestCheckHook

  ];



  pythonImportsCheck = [ "sumo" ];



  meta = with lib; {

  meta = {

    description = "Toolkit for plotting and analysis of ab initio solid-state calculation data";

    homepage = "https://github.com/SMTG-UCL/sumo";

    changelog = "https://github.com/SMTG-Bham/sumo/releases/tag/v${version}";

    license = licenses.mit;

    maintainers = with maintainers; [ psyanticy ];

    license = lib.licenses.mit;

    maintainers = with lib.maintainers; [ psyanticy ];

  };

}