.coveragerc
.gitignore
.readthedocs.yaml
AUTHORS.rst
CHANGELOG.md
CONTRIBUTING.rst
LICENSE.txt
MANIFEST.in
README.md
pyproject.toml
setup.cfg
setup.py
tox.ini
version.txt
.github/workflows/publish-on-pypi.yml
.github/workflows/release-please.yml
docs/Makefile
docs/conf.py
docs/index.rst
docs/make.bat
docs/requirements.txt
docs/manual/AnalysisFunctions.rst
docs/manual/Installation.rst
docs/manual/PlotWithFullereneDataParser_2.rst
docs/manual/SimulationModules.rst
docs/manual/fig/C60_ih_Br.png
docs/manual/fig/Cl_addon_len.png
docs/manual/fig/Clean.png
docs/manual/fig/Path_relative_energy.png
docs/manual/fig/SWR.png
docs/manual/fig/addon.png
docs/manual/fig/after_step.png
docs/manual/fig/all_parent_info.png
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docs/manual/fig/dpdispatch_arch.png
docs/manual/fig/e_area.png
docs/manual/fig/failed_example.png
docs/manual/fig/first_step.png
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docs/manual/fig/pathway_pickle.png
docs/manual/fig/pathway_problems.png
docs/manual/fig/pathway_search_workflow.png
docs/manual/fig/plot_swr.png
docs/manual/fig/plot_with_label.png
docs/manual/fig/pre_scan_folder.png
docs/manual/fig/pure.png
docs/manual/fig/re_plot_with_label.png
docs/manual/fig/root.png
docs/manual/fig/scale_font_only.png
docs/manual/fig/simple_plot.png
docs/manual/fig/status_info.png
docs/manual/fig/sub_batch_arch.png
docs/manual/fig/swr_count_result.png
docs/manual/fig/swr_folder_system.png
docs/manual/fig/swr_problem.png
docs/manual/fig/swr_workflow.png
docs/manual/fig/zoom_in.png
docs/miscellaneous/changelog.rst
docs/miscellaneous/contributing.rst
docs/miscellaneous/license.rst
src/AutoSteper.egg-info/PKG-INFO
src/AutoSteper.egg-info/SOURCES.txt
src/AutoSteper.egg-info/dependency_links.txt
src/AutoSteper.egg-info/not-zip-safe
src/AutoSteper.egg-info/requires.txt
src/AutoSteper.egg-info/top_level.txt
src/autosteper/__init__.py
src/autosteper/autosteper.py
src/autosteper/cage.py
src/autosteper/checker.py
src/autosteper/generator.py
src/autosteper/optimizers.py
src/autosteper/parallel_unit.py
src/autosteper/parser.py
src/autosteper/plotter.py
src/autosteper/tools.py