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nixpkgs/pkgs/development/python-modules/pymatgen/default.nix
Chris Ostrouchov 63cf879d6c
pythonPackages.pymatgen: 2018.8.10 -> 2018.9.1
Also 2018.8.10 does not build in previous state because auto updating
from pypi did not account for a new requirement `networkx`. This has
been added.
2018-09-06 00:04:28 -04:00

25 lines
922 B
Nix

{ stdenv, buildPythonPackage, fetchPypi, glibcLocales, numpy, pydispatcher, sympy, requests, monty, ruamel_yaml, six, scipy, tabulate, enum34, matplotlib, palettable, spglib, pandas, networkx }:
buildPythonPackage rec {
pname = "pymatgen";
version = "2018.9.1";
src = fetchPypi {
inherit pname version;
sha256 = "dee5dbd8008081de9f27759c20c550d09a07136eeebfe941e3d05fd88ccace18";
};
nativeBuildInputs = [ glibcLocales ];
propagatedBuildInputs = [ numpy pydispatcher sympy requests monty ruamel_yaml six scipy tabulate enum34 matplotlib palettable spglib pandas networkx ];
# No tests in pypi tarball.
doCheck = false;
meta = with stdenv.lib; {
description = "A robust materials analysis code that defines core object representations for structures and molecules";
homepage = http://pymatgen.org/;
license = licenses.mit;
maintainers = with maintainers; [ psyanticy ];
};
}