LICENSE
MANIFEST.in
README.md
setup.json
setup.py
aiida_codtools/__init__.py
aiida_codtools.egg-info/PKG-INFO
aiida_codtools.egg-info/SOURCES.txt
aiida_codtools.egg-info/dependency_links.txt
aiida_codtools.egg-info/entry_points.txt
aiida_codtools.egg-info/requires.txt
aiida_codtools.egg-info/top_level.txt
aiida_codtools/calculations/__init__.py
aiida_codtools/calculations/cif_base.py
aiida_codtools/calculations/cif_cell_contents.py
aiida_codtools/calculations/cif_cod_check.py
aiida_codtools/calculations/cif_cod_deposit.py
aiida_codtools/calculations/cif_cod_numbers.py
aiida_codtools/calculations/cif_filter.py
aiida_codtools/calculations/cif_select.py
aiida_codtools/calculations/cif_split_primitive.py
aiida_codtools/calculations/functions/__init__.py
aiida_codtools/calculations/functions/primitive_structure_from_cif.py
aiida_codtools/cli/__init__.py
aiida_codtools/cli/calculations/__init__.py
aiida_codtools/cli/calculations/cod_tools.py
aiida_codtools/cli/data/__init__.py
aiida_codtools/cli/data/cif.py
aiida_codtools/cli/utils/__init__.py
aiida_codtools/cli/utils/display.py
aiida_codtools/cli/utils/launch.py
aiida_codtools/cli/utils/parameters.py
aiida_codtools/cli/utils/validate.py
aiida_codtools/cli/workflows/__init__.py
aiida_codtools/cli/workflows/cif_clean.py
aiida_codtools/common/__init__.py
aiida_codtools/common/resources.py
aiida_codtools/common/utils.py
aiida_codtools/parsers/__init__.py
aiida_codtools/parsers/cif_base.py
aiida_codtools/parsers/cif_cell_contents.py
aiida_codtools/parsers/cif_cod_check.py
aiida_codtools/parsers/cif_cod_deposit.py
aiida_codtools/parsers/cif_cod_numbers.py
aiida_codtools/parsers/cif_split_primitive.py
aiida_codtools/workflows/__init__.py
aiida_codtools/workflows/cif_clean.py
docs/.gitignore
docs/Makefile
docs/requirements_for_rtd.txt
docs/source/conf.py
docs/source/index.rst
docs/source/images/AiiDA_transparent_logo.png
docs/source/images/codsmall.jpg
docs/source/images/swissuniversities.png
docs/source/module_guide/calculations.rst
docs/source/module_guide/index.rst
docs/source/module_guide/parsers.rst
docs/source/user_guide/cif_base.rst
docs/source/user_guide/cif_cell_contents.rst
docs/source/user_guide/cif_cod_check.rst
docs/source/user_guide/cif_cod_deposit.rst
docs/source/user_guide/cif_cod_numbers.rst
docs/source/user_guide/cif_split_primitive.rst
docs/source/user_guide/index.rst
tests/conftest.py
tests/calculations/__init__.py
tests/calculations/test_cif_cod_deposit.py
tests/calculations/test_cif_cod_deposit/test_cif_cod_deposit.cfg
tests/calculations/test_cif_cod_deposit/test_cif_cod_deposit.in
tests/cli/data/__init__.py
tests/cli/data/test_cif.py
tests/common/__init__.py
tests/common/test_cli.py
tests/fixtures/cif/Si.cif
tests/parsers/__init__.py
tests/parsers/test_cif_cell_contents.py
tests/parsers/test_cif_cod_check.py
tests/parsers/test_cif_cod_deposit.py
tests/parsers/test_cif_cod_numbers.py
tests/parsers/test_cif_filter.py
tests/parsers/test_cif_split_primitive.py
tests/parsers/fixtures/cif_cell_contents/default/aiida.err
tests/parsers/fixtures/cif_cell_contents/default/aiida.out
tests/parsers/fixtures/cif_cod_check/default/aiida.err
tests/parsers/fixtures/cif_cod_check/default/aiida.out
tests/parsers/fixtures/cif_cod_deposit/invalid_configuration/aiida.err
tests/parsers/fixtures/cif_cod_deposit/invalid_configuration/aiida.out
tests/parsers/fixtures/cif_cod_numbers/default/aiida.err
tests/parsers/fixtures/cif_cod_numbers/default/aiida.out
tests/parsers/fixtures/cif_filter/default/aiida.err
tests/parsers/fixtures/cif_filter/default/aiida.out
tests/parsers/fixtures/cif_filter/invalid_cif/aiida.err
tests/parsers/fixtures/cif_filter/invalid_cif/aiida.out
tests/parsers/fixtures/cif_split_primitive/default/aiida.err
tests/parsers/fixtures/cif_split_primitive/default/aiida.out
tests/parsers/fixtures/cif_split_primitive/default/split/input_1000000.cif
tests/parsers/fixtures/cif_split_primitive/default/split/input_1000002.cif
utils/__init__.py
utils/fastentrypoints.py
utils/validate_version_number.py