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Revert "fix: correct liten_spice2_int overall_score (mean over its 13 existing benchmarks)"
This reverts commit 06e3c3799816dab2cbd52b4be1bd64b5cc3e73a5. -
fix: correct liten_spice2_int overall_score (mean over its 13 existing benchmarks)
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fix: rebuild score.json overall_score from per-benchmark result.json (undo subset-clobber); drop renamed small_molecule_minimization from MACE-OFF/MP
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feat: refresh internal v1 + MACE-OFF/MP results (re-scored FS #163, inference_speed, drop scaling); remove unfinished 1416 (MACE-SPICE2) and UMA folders
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feat: update visnet-spice2-t1x biomolecules (#6)
- feat: update biomolecules results (c1d6c5834eb4789ecfc83d6b488e3a96b59197c7)
- feat: update visnet-spice2-t1x scores with biomolecules (b17e876162c2aa690be7f672ff0218d084aa4048) -
feat: half visnet-spice2-t1x fs trajectories (#5)
- feat: halve FS trajectories length (f991b7793b16d2116fa46dceece7927dc82e3698)
- fix: removing first half (c38ea93172992b651d3b8f910379e4bcf64cb1ed)
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feat: update scores (#4)
- feat: add conformer selection to mace-off (febaaf6e265f22439d4a4cbcd6fc8e66da6f417c)
- feat: remove bh9 and neb results (787c7d740b1fd8bc4626d81c41f82725a4d42fdc)
- feat: remove sampling_boxes (d7745b033ca66fed393561fe118dde8be8d811c9)
- feat: update overall scores (eeb34101d322662227c143aa22bb9037cea35d05) -
feat: update sampling results (#3)
- feat: update sampling results (a1f9be2ed749fd19a33f695b68f0576c4b5be5c8)
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feat: update uma-small with folding stability
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Create README.md
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feat: rename minimization benchmark inside score.json files
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feat: rename models and update minimization benchmark name
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feat: upload latest results
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feat: remove bh9
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chore: Merge branch 'pr/1' into pr/2
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feat: remove dev results
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feat: add .gitignore
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add-visnet-organics-standard (#1)
- feat: add visnet organics standard results (c54ef01c1a86cdee699e404d80021bda92513097) -
feat: remove bh9
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feat: add visnet organics standard results
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Delete visnet_reactive_bad_int
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Delete nequip_organics_ext
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Upload 73 files
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Delete model_1930_int
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Upload 11 files
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Delete visnet_reactive_bad
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Upload 11 files
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Upload 11 files
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Delete model_1922_int
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Upload 11 files
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Upload 11 files
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Upload 11 files
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Update nequip_organics_ext/score.json
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add two new models for display in the beta testing public leaderboard
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Update nequip_organics_01_int/score.json
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Update visnet_organics_01_ext/score.json
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Upload 15 files
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Upload 16 files
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Delete visnet_organics_01_test
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Upload 16 files
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initial commit