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python3.pkgs.dftfit: remove

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This commit is contained in:
Jörg Thalheim 2021-07-03 08:44:34 +02:00
parent 887d449c2d
commit 18b6027ad1
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GPG key ID: B3F5D81B0C6967C4
2 changed files with 0 additions and 54 deletions
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52
pkgs/development/python-modules/dftfit/default.nix
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@ -1,52 +0,0 @@
{ lib
, fetchPypi
, buildPythonPackage
, pymatgen
, marshmallow
, pyyaml
, pygmo
, pandas
, scipy
, numpy
, scikit-learn
, lammps-cython
, pymatgen-lammps
, pytestrunner
, isPy3k
}:
buildPythonPackage rec {
pname = "dftfit";
version = "0.5.1";
disabled = (!isPy3k);
src = fetchPypi {
inherit pname version;
sha256 = "4dcbde48948835dcf2d49d6628c9df5747a8ec505d517e374b8d6c7fe95892df";
};
buildInputs = [ pytestrunner ];
propagatedBuildInputs = [
pymatgen
marshmallow
pyyaml
pygmo
pandas
scipy
numpy
scikit-learn
lammps-cython
pymatgen-lammps
];
# tests require git lfs download. and is quite large so skip tests
doCheck = false;
pythonImportsCheck = [ "dftfit" ];
meta = {
description = "Ab-Initio Molecular Dynamics Potential Development";
homepage = "https://gitlab.com/costrouc/dftfit";
license = lib.licenses.mit;
maintainers = with lib.maintainers; [ costrouc ];
};
}

2
pkgs/top-level/python-packages.nix
View file

@ -1905,8 +1905,6 @@ in {
devpi-common = callPackage ../development/python-modules/devpi-common { };
dftfit = callPackage ../development/python-modules/dftfit { };
diagrams = callPackage ../development/python-modules/diagrams { };
diceware = callPackage ../development/python-modules/diceware { };