LICENSE
pyproject.toml
readme.md
env/bin/activate_this.py
ppqm/__init__.py
ppqm/calculator.py
ppqm/chembridge.py
ppqm/constants.py
ppqm/gamess.py
ppqm/gaussian.py
ppqm/jupyter.py
ppqm/mndo.py
ppqm/mopac.py
ppqm/orca.py
ppqm/tasks.py
ppqm/units.py
ppqm/version.py
ppqm/xtb.py
ppqm.egg-info/PKG-INFO
ppqm.egg-info/SOURCES.txt
ppqm.egg-info/dependency_links.txt
ppqm.egg-info/requires.txt
ppqm.egg-info/top_level.txt
ppqm/utils/__init__.py
ppqm/utils/env.py
ppqm/utils/files.py
ppqm/utils/functools.py
ppqm/utils/linesio.py
ppqm/utils/shell.py
tests/conftest.py
tests/test_chembridge.py
tests/test_gamess.py
tests/test_gaussian.py
tests/test_linesio.py
tests/test_mndo.py
tests/test_mopac.py
tests/test_orca.py
tests/test_shell.py
tests/test_xtb.py