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add SevenNet to Matbench Discovery leaderboard #112

Merged
merged 35 commits into from
Jul 15, 2024
Merged

add SevenNet to Matbench Discovery leaderboard #112

merged 35 commits into from
Jul 15, 2024

Commits on Jul 13, 2024

  1. add SevenNet to Matbench Discovery leaderboard

    @YutackPark
    YutackPark committed Jul 13, 2024
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  2. chore: rename yaml

    @YutackPark
    YutackPark committed Jul 13, 2024
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  3. [pre-commit.ci] auto fixes from pre-commit.com hooks 

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  4. Update sevennet.yml fixing date and adding hyperparameters

    @CompRhys
    CompRhys committed Jul 13, 2024
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  5. fea: add to enums and pred_files

    @CompRhys
    CompRhys committed Jul 13, 2024
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  6. fea: add to enum and pred files

    @CompRhys
    CompRhys committed Jul 13, 2024
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  7. [pre-commit.ci] auto fixes from pre-commit.com hooks 

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  8. test: fix version test

    @CompRhys
    CompRhys committed Jul 13, 2024
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  9. [pre-commit.ci] auto fixes from pre-commit.com hooks 

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  10. clean: refer to model as SevenNet-0 and version as 22July2024, more m… 

    …etadata
    @CompRhys
    CompRhys committed Jul 13, 2024
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  12. fix: version must match col names so bump max model version name length

    @CompRhys
    CompRhys committed Jul 13, 2024
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  13. add SevenNet to metrics tables

    @janosh
    janosh committed Jul 13, 2024
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  14. add SevenNet to model-stats.json

    @janosh
    janosh committed Jul 13, 2024
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  15. fea: add autodownload of checkpoint and lint

    @CompRhys
    CompRhys committed Jul 13, 2024
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  16. fix: remote duplicate file path

    @CompRhys
    CompRhys committed Jul 13, 2024
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  17. fix: mypy error

    @CompRhys
    CompRhys committed Jul 13, 2024
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  18. maint: add openness to all

    @CompRhys
    CompRhys committed Jul 13, 2024
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Commits on Jul 14, 2024

  1. Merge branch 'janosh:sevennet' into sevennet

    @YutackPark
    YutackPark committed Jul 14, 2024
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  2. fix: remove duplicate merge error

    @CompRhys
    CompRhys committed Jul 14, 2024
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  3. fix: sevennet.yml hyperparameters

    @YutackPark
    YutackPark committed Jul 14, 2024
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  5. clean: move whitespace line

    @CompRhys
    CompRhys committed Jul 14, 2024
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  6. Merge remote-tracking branch 'origin/main' into pr/YutackPark/112

    @janosh
    janosh committed Jul 14, 2024
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  7. update site figs adding SevenNet, GNoME and MatterSim

    @janosh
    janosh committed Jul 14, 2024
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Commits on Jul 15, 2024

  1. add missing orcid id in

    @YutackPark
    YutackPark committed Jul 15, 2024
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  2. add: training script for sevennet

    @YutackPark
    YutackPark committed Jul 15, 2024
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  3. [pre-commit.ci] auto fixes from pre-commit.com hooks 

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  4. fix: convert_MPTrj2xyz.py

    @YutackPark
    YutackPark committed Jul 15, 2024
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  6. refactor: clean and type annotated convert_MPTrj2xyz.py

    @YutackPark
    YutackPark committed Jul 15, 2024
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  8. get sevennet_root from sevenn.__path__

    @janosh
    janosh committed Jul 15, 2024
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  9. refactor sevennet/join_results.py 

    rename write_no_bad.py to filter_bad_preds.py
    @janosh
    janosh committed Jul 15, 2024
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  10. refactor sevennet/train_sevennet/convert_MPTrj2xyz.py

    @janosh
    janosh committed Jul 15, 2024
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