microsoft / Graphormer

Graphormer is a general-purpose deep learning backbone for molecular modeling.
MIT License
2k stars 324 forks source link

How can I save outputs for my Graphormer model #157

Open Ruskinkot1 opened 1 year ago

Ruskinkot1 commented 1 year ago

How can I save the outputs of the model for each datapoint during evaluation on pre-trained model