{ lib , buildPythonPackage , fetchPypi , psutil , py-cpuinfo , pydantic , pytestCheckHook , pythonOlder , pyyaml , qcelemental , msgpack }: buildPythonPackage rec { pname = "qcengine"; version = "0.28.1"; format = "setuptools"; disabled = pythonOlder "3.7"; src = fetchPypi { inherit pname version; hash = "sha256-ebZayF5VGHXjBFO3k2KegCNqAFygB3BXKvdvr8mF/Ss="; }; propagatedBuildInputs = [ psutil py-cpuinfo pydantic pyyaml qcelemental msgpack ]; nativeCheckInputs = [ pytestCheckHook ]; pythonImportsCheck = [ "qcengine" ]; meta = with lib; { description = "Quantum chemistry program executor and IO standardizer (QCSchema) for quantum chemistry"; homepage = "http://docs.qcarchive.molssi.org/projects/qcelemental/"; license = licenses.bsd3; maintainers = with maintainers; [ sheepforce ]; }; }