microsoft/FS-Mol

Possible Error in Dataset Notebook

AustinT opened this issue · 1 comments

Hello,

In your example notebook for datasets (https://github.com/microsoft/FS-Mol/blob/main/notebooks/dataset.ipynb) the dataset path seems to be wrong. You have put FS_MOL_DATASET_PATH = os.path.join(os.environ['HOME'], "Datasets", "FS-Mol"), but for it to work I had to change this to FS_MOL_DATASET_PATH = os.path.join(os.environ['HOME'], "Datasets", "FS-Mol", "datasets") (i.e. use the "/datasets" dir instead of the base dir in the repo). Perhaps you could update this if it is a mistake, or clarify it if it is not a mistake?

Thank you for the spot. It will be changed to reflect the repo directory structure.