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DepFAENet not using tag info

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@AlexDuvalinho AlexDuvalinho released this 16 Jan 14:59
· 5 commits to disconnected_gnn since this release
  • DepFAENet trained on whole dataset
  • Without graph rewiring step (all atoms)
  • Without tag information
  • Not fine-tuned on specific adsorbates yet

Run:
https://wandb.ai/mila-ocp/ocp-alvaro/runs/4023244-depfaenet-is2re-all/overview?workspace=user-alex_duvalinho