25 lines
923 B
Nix
25 lines
923 B
Nix
{ stdenv, buildPythonPackage, fetchPypi, glibcLocales, numpy, pydispatcher, sympy, requests, monty, ruamel_yaml, six, scipy, tabulate, enum34, matplotlib, palettable, spglib, pandas, networkx }:
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buildPythonPackage rec {
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pname = "pymatgen";
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version = "2018.9.30";
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src = fetchPypi {
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inherit pname version;
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sha256 = "08c8da84beec153c0ad7acc47e67245e2d6598169e9803b82bd53131a67293be";
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};
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nativeBuildInputs = [ glibcLocales ];
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propagatedBuildInputs = [ numpy pydispatcher sympy requests monty ruamel_yaml six scipy tabulate enum34 matplotlib palettable spglib pandas networkx ];
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# No tests in pypi tarball.
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doCheck = false;
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meta = with stdenv.lib; {
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description = "A robust materials analysis code that defines core object representations for structures and molecules";
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homepage = http://pymatgen.org/;
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license = licenses.mit;
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maintainers = with maintainers; [ psyanticy ];
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};
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}
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