Datasets:
Update README.md
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README.md
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@@ -62,69 +62,26 @@ then, from within python load the datasets library
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To load structures from the entire `SAbDab` dataset, use `datasets.load_dataset(...)`:
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>>>
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data_dir = f"{dataset_tag}")['train']
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and the dataset is loaded as a `datasets.arrow_dataset.Dataset`
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>>>
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'model',
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'antigen_chain',
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'antigen_type',
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'antigen_het_name',
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'antigen_name',
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'short_header',
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'date',
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'compound',
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'organism',
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'heavy_species',
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'light_species',
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'antigen_species',
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'authors',
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'resolution',
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'method',
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'r_free',
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'r_factor',
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'scfv',
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'engineered',
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'heavy_subclass',
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'light_subclass',
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'light_ctype',
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'affinity',
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'delta_g',
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'affinity_method',
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'temperature',
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'pmid'
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'abangle',
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'annotation_H',
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'annotation_L',
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'imgt_H',
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'imgt_L',
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'sequence_raw',
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'sequence_H',
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'sequence_L',
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'structure',
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'structure_chothia',
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'in_nr_set',
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'curated_quality_dataset',
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'split'
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],
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num_rows: 20701
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})
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which is a column oriented format that can be accessed directly, converted in to a `pandas.DataFrame`, or `parquet` format, e.g.
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>>>
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>>>
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>>>
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## Dataset Details
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To load structures from the entire `SAbDab` dataset, use `datasets.load_dataset(...)`:
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>>> SAbDab= datasets.load_dataset("RosettaCommons/SAbDab")
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Downloading readme: 7.87kB [00:00, 2.73MB/s]
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Downloading data: 100%|█████████████████████████████████████████████████████████████████████████████████████████████████| 15.7M/15.7M [00:01<00:00, 8.22MB/s]
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Generating train split: 100%|████████████████████████████████████████████████████████████████████████████████| 20700/20700 [00:00<00:00, 80378.32 examples/s]
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and the dataset is loaded as a `datasets.arrow_dataset.Dataset`
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>>> SAbDab
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DatasetDict({
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train: Dataset({
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features: ['pdb', 'Hchain', 'Lchain', 'model', 'antigen_chain', 'antigen_type', 'antigen_het_name', 'antigen_name', 'short_header', 'date', 'compound', 'organism', 'heavy_species', 'light_species', 'antigen_species', 'authors', 'resolution', 'method', 'r_free', 'r_factor', 'scfv', 'engineered', 'heavy_subclass', 'light_subclass', 'light_ctype', 'affinity', 'delta_g', 'affinity_method', 'temperature', 'pmid', 'abangle', 'annotation_H', 'annotation_L', 'imgt_H', 'imgt_L', 'sequence_raw', 'sequence_H', 'sequence_L', 'structure', 'structure_chothia', 'in_nr_set', 'curated_quality_dataset', 'split'],
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num_rows: 20700
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})
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})
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which is a column oriented format that can be accessed directly, converted in to a `pandas.DataFrame`, or `parquet` format, e.g.
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>>> SAbDab.data.column('pdb')
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>>> SAbDab.to_pandas()
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>>> SAbDab.to_parquet("dataset.parquet")
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## Dataset Details
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