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Graphium Datasets

Graphium datasets are hosted at on Google Cloud Storage at gs://graphium-public/datasets. Graphium provides a convenient utility functions to list and download those datasets:

import graphium

dataset_dir = "/my/path"
data_path = graphium.data.utils.download_graphium_dataset("graphium-zinc-micro", output_path=dataset_dir)
print(data_path)
# /my/path/graphium-zinc-micro

graphium-zinc-micro

ADD DESCRIPTION.

  • Number of molecules: xxx
  • Label columns: xxx
  • Split informations.

graphium-zinc-bench-gnn

ADD DESCRIPTION.

  • Number of molecules: xxx
  • Label columns: xxx- Split informations.