*.prof
__pycache__
/data
a.out
/test.py
/.vscode
/build*
.eggs
*.egg-info
*.ninja
/torchani.egg-info
/*.h5
/*.hdf5
.ipynb_checkpoints
benchmark_xyz
*.pyc
*checkpoint*
*.pt
/tests/runs
/quicktest.py
/*.ipt
/*.params
/*.dat
*.o
*.so
*.ninja_log
/tmp
*_cache
datacache
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*.pckl
# No vim swap files
*.swp
*.swo
/download
/download.tar.xz
*.qdrep
*.qdstrm
*.zip
Untitled.ipynb
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/test*.py
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htmlcov/
/include
training_outputs/
examples/dataset.pkl