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python3.pkgs.qcelemental: 0.23.0 -> 0.24.0

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python3.pkgs.qcelemental: whitespace


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qcelemental: checkPhase
This commit is contained in:
Phillip Seeber 2021-11-22 14:22:12 +01:00
parent 263ef4cc41
commit 51f4d2d2cd
1 changed files with 17 additions and 8 deletions
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25
pkgs/development/python-modules/qcelemental/default.nix
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@ -1,26 +1,35 @@
{ buildPythonPackage, lib, fetchPypi, numpy
, pydantic, pint, networkx, pytest-runner, pytest-cov, pytest
{ buildPythonPackage, lib, fetchPypi
, networkx
, numpy
, pint
, pydantic
, pytestCheckHook
} :
buildPythonPackage rec {
pname = "qcelemental";
version = "0.23.0";
checkInputs = [ pytest-runner pytest-cov pytest ];
propagatedBuildInputs = [ numpy pydantic pint networkx ];
version = "0.24.0";
src = fetchPypi {
inherit pname version;
sha256 = "642bc86ce937621ddfb1291cbff0851be16b26feb5eec562296999e36181cee3";
sha256 = "sha256-XcsR89tu26EG5AcXqmndkESLGWZ8eKmTkjaLziosawE=";
};
propagatedBuildInputs = [
numpy
pydantic
pint
networkx
];
checkInputs = [ pytestCheckHook ];
doCheck = true;
meta = with lib; {
description = "Periodic table, physical constants, and molecule parsing for quantum chemistry";
homepage = "http://docs.qcarchive.molssi.org/projects/qcelemental/en/latest/";
license = licenses.bsd3;
platforms = platforms.linux;
maintainers = [ maintainers.sheepforce ];
};
}