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Datasets:

LMucko
/

qm9

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Dataset card Data Studio Files Files and versions

26.4 MB

1 contributor

History: 6 commits

LMucko's picture

Keep only atoms and coords in QM9

dd52e18 verified about 23 hours ago

.gitattributes

2.5 kB
initial commit 7 days ago
README.md

172 Bytes
Keep only atoms and coords in QM9 about 23 hours ago
prepare_qm9_parquet.py

19.2 kB
Add QM9 preparation script 7 days ago
qm9_test.parquet

2.59 MB
xet

Keep only atoms and coords in QM9 about 23 hours ago
qm9_train.parquet

19.8 MB
xet

Keep only atoms and coords in QM9 about 23 hours ago
qm9_valid.parquet

3.51 MB
xet

Keep only atoms and coords in QM9 about 23 hours ago
uncharacterized.txt

487 kB
Add QM9 exclusion list 7 days ago