.gitignore

.DS_Store
*.npy
*.dat
*.tdt
*.tfn
*.tfm
*.log
*-chk-*
*checkpoint*
*.tfevents.*
*events.out*
*.pdb
*_NEQ.pdb* # don't save random distortions.
*.raw
datasets/*.pdb
results/*.log
logs/*.log
qchem/*
results/*.xyz
timeline_step*
__pycache__/
*.py[cod]
*$py.class
datasets
networks
results

# C extensions
*.so

# Distribution / packaging
doc/_build
.Python
env/
build/
develop-eggs/
dist/
downloads/
eggs/
.eggs/
lib/
lib64/
parts/
sdist/
var/
*.egg-info/
.installed.cfg
*.egg

# PyInstaller
#  Usually these files are written by a python script from a template
#  before PyInstaller builds the exe, so as to inject date/other infos into it.
*.manifest
*.spec

# Installer logs
pip-log.txt
pip-delete-this-directory.txt

# PyBuilder
target/

# IPython Notebook
.ipynb_checkpoints

# pyenv
.python-version

# celery beat schedule file
celerybeat-schedule

# dotenv
.env

# virtualenv
.venv/
venv/
ENV/