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Add benchamrk/dataset checkers/validators #13

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knc6 opened this issue Mar 3, 2023 · 0 comments
Open
4 tasks

Add benchamrk/dataset checkers/validators #13

knc6 opened this issue Mar 3, 2023 · 0 comments

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@knc6
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knc6 commented Mar 3, 2023

  • Whether the benchmark has entries for all the keys in the dataset
  • If the new benchmark already exists, e.g. a user just uploads the example alignn exfoliation energy as a new benchmark name
  • Avoid property name duplication, for example formation_energy_peratom should be in dft_3d dataset only and not in say hmof dataset to avoid any conflict
  • Mixing accuracies say MAE and ACC e.g. for bandgap models
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