Datasets:

Jainamshahhh
/

molperceive

Tasks:

Question Answering

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Tags:

molecular-property-prediction

structure-elucidation

adaption-autoscientist

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Dataset card Data Studio Files Files and versions

375 MB

1 contributor

History: 42 commits

Jainamshahhh's picture

Upload README.md with huggingface_hub

c328d55 verified 12 days ago

common
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plots
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verdicts
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.gitattributes

2.7 kB
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README.md

8.46 kB
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adaption_policy.py

12.6 kB
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build_retrain.py

4.1 kB
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day0_reserved_inchikeys.txt

6.31 kB
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decontam_molperceive.py

7.29 kB
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derive.py

13.4 kB
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fields.py

17.7 kB
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gate_molperceive.py

30.9 kB
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graph2smiles.py

5.36 kB
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hand_formulas.json

16 kB
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hand_formulas.sha256

379 Bytes
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hand_formulas_appendix_aromatic.json

8.27 kB
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hand_formulas_appendix_aromatic.sha256

271 Bytes
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hard_shard.py

21.9 kB
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indep_parser.py

26.2 kB
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molperceive_day0_probes.jsonl

967 kB
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molperceive_day0_probes_regate.jsonl

969 kB
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molperceive_hard_shard.jsonl

34.2 MB
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molperceive_holdout_ccd.jsonl

583 kB
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molperceive_holdout_hard.jsonl

854 kB
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molperceive_holdout_novel_scaffold.jsonl

1.42 MB
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molperceive_holdout_paraphrase.jsonl

551 kB
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molperceive_holdout_random_order.jsonl

565 kB
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molperceive_holdout_seen_scaffold.jsonl

822 kB
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molperceive_retrain_mixture.jsonl

83.9 MB
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molperceive_train.jsonl

249 MB
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parser_first_run_classification.md

13 kB
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s2_falsifiability_repair.md

9.41 kB
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score_molperceive.py

68.1 kB
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significance.py

9.65 kB
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