setup.json

{
    "author": "The AiiDA team",
    "author_email": "developers@aiida.net",
    "classifiers": [
        "Development Status :: 4 - Beta",
        "Framework :: AiiDA",
        "License :: OSI Approved :: MIT License",
        "Operating System :: POSIX :: Linux",
        "Operating System :: MacOS :: MacOS X",
        "Programming Language :: Python",
        "Programming Language :: Python :: 3.7",
        "Programming Language :: Python :: 3.8",
        "Programming Language :: Python :: 3.9"
    ],
    "description": "AiiDA package with utilities and interfaces for common workflows.",
    "python_requires": ">=3.7",
    "install_requires": [
        "abipy",
        "aiida-abinit~=0.2.0a1",
        "aiida-bigdft>=0.2.6",
        "aiida-castep>=1.2.0a5",
        "aiida-core[atomic_tools]~=1.6",
        "aiida-cp2k~=1.3",
        "aiida-fleur>=1.1.4",
        "aiida-gaussian",
        "aiida-nwchem>=2.1.0",
        "aiida-orca",
        "aiida-pseudo>=0.6.0",
        "aiida-quantumespresso~=3.4,>=3.4.1",
        "aiida-siesta~=1.1",
        "aiida-vasp",
        "pymatgen<=2021.3.3",
        "sqlalchemy<1.4",
	"ase!=3.20.*"
    ],
    "extras_require": {
        "docs": [
            "docutils~=0.15.2",
            "pygments~=2.5",
            "pydata-sphinx-theme~=0.4.0",
            "sphinx~=3.2",
            "sphinx-panels~=0.5.0",
            "sphinxcontrib-details-directive~=0.1.0",
            "sphinx-copybutton~=0.3.0"
        ],
        "pre-commit": [
            "pre-commit~=2.2",
            "pylint~=2.5.2",
            "yapf~=0.29"
        ],
        "tests": [
            "pytest~=5.4",
            "pgtest~=1.3,>=1.3.1",
            "pytest-regressions~=1.0"
        ]
    },
    "entry_points": {
        "console_scripts": [
            "aiida-common-workflows = aiida_common_workflows.cli:cmd_root"
        ],
        "aiida.workflows": [
            "common_workflows.dissociation_curve = aiida_common_workflows.workflows.dissociation:DissociationCurveWorkChain",
            "common_workflows.eos = aiida_common_workflows.workflows.eos:EquationOfStateWorkChain",
            "common_workflows.relax.abinit = aiida_common_workflows.workflows.relax.abinit.workchain:AbinitCommonRelaxWorkChain",
            "common_workflows.relax.bigdft = aiida_common_workflows.workflows.relax.bigdft.workchain:BigDftCommonRelaxWorkChain",
            "common_workflows.relax.castep = aiida_common_workflows.workflows.relax.castep.workchain:CastepCommonRelaxWorkChain",
            "common_workflows.relax.cp2k = aiida_common_workflows.workflows.relax.cp2k.workchain:Cp2kCommonRelaxWorkChain",
            "common_workflows.relax.fleur = aiida_common_workflows.workflows.relax.fleur.workchain:FleurCommonRelaxWorkChain",
            "common_workflows.relax.gaussian = aiida_common_workflows.workflows.relax.gaussian.workchain:GaussianCommonRelaxWorkChain",
            "common_workflows.relax.nwchem = aiida_common_workflows.workflows.relax.nwchem.workchain:NwchemCommonRelaxWorkChain",
            "common_workflows.relax.orca = aiida_common_workflows.workflows.relax.orca.workchain:OrcaCommonRelaxWorkChain",
            "common_workflows.relax.quantum_espresso = aiida_common_workflows.workflows.relax.quantum_espresso.workchain:QuantumEspressoCommonRelaxWorkChain",
            "common_workflows.relax.siesta = aiida_common_workflows.workflows.relax.siesta.workchain:SiestaCommonRelaxWorkChain",
            "common_workflows.relax.vasp = aiida_common_workflows.workflows.relax.vasp.workchain:VaspCommonRelaxWorkChain",
            "common_workflows.bands.siesta = aiida_common_workflows.workflows.bands.siesta.workchain:SiestaCommonBandsWorkChain"
        ]
    },
    "license": "MIT License",
    "name": "aiida-common-workflows",
    "url": "https://github.com/aiidateam/aiida-common-workflows",
    "version": "0.1.0"
}