Garden-AI / garden

https://garden-ai.readthedocs.io
MIT License
21 stars 4 forks source link

Reproduce Materials Screening Result in Garden #509

Closed WillEngler closed 3 months ago

WillEngler commented 4 months ago

Ryan Jacobs published the paper that featured his materials property garden recently. (link) We should see if we can reproduce his results using the models hosted in Garden.

Assumptions:

  1. The code Ryan used to run the screening and generate plots are in a Jupyter notebook in FigShare. (link)
  2. If the datasets he's using aren't in Foundry/MDF, let's get them in.

Acceptance Criteria

The deliverable for this is either ...

WillEngler commented 3 months ago

Did it! https://colab.research.google.com/drive/1IDEIuqvfSfYK09IBinbbq1WFWiLB7kNz#scrollTo=nEAqEO_Yidi1