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predict.py AssertionError #6

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chupvl opened this issue Jan 29, 2019 · 1 comment
Closed

predict.py AssertionError #6

chupvl opened this issue Jan 29, 2019 · 1 comment

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@chupvl
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chupvl commented Jan 29, 2019

python predict.py --test_path data/tox21.csv --checkpoint_dir tox21_checkpoints --preds_path tox21_preds.csv

Traceback (most recent call last):
File "predict.py", line 6, in
make_predictions(args)
File "/home/chupvl/git/chemprop/chemprop/train/make_predictions.py", line 30, in make_predictions
assert smiles is not None # Note: Currently only works with smiles provided, not with data file.
AssertionError

@swansonk14
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Fixed in this commit

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