Datasets:
Languages:
English
Size:
10M - 100M
ArXiv:
Tags:
chemistry
scientific-language-interfaced-data
multimodality-data
molecular-imaging
tabular-data
chemistry-mlift
License:
Add cav3_t-type_calcium_channels_butkiewicz-multimodal config via script (part 00001-of-00002)
Browse files- README.md +44 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00000-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00001-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00002-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00003-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00004-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00005-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00006-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00007-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00008-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00009-of-00010.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/train-00040-of-00044.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/train-00041-of-00044.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/train-00042-of-00044.parquet +3 -0
- cav3_t-type_calcium_channels_butkiewicz-multimodal/train-00043-of-00044.parquet +3 -0
README.md
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@@ -526,6 +526,42 @@ dataset_info:
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num_examples: 580
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download_size: 5021063
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dataset_size: 92999668.2
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- config_name: chebi_20-multimodal
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features:
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- name: IMAGE
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path: carcinogens-multimodal/test-*
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- split: validation
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path: carcinogens-multimodal/validation-*
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- config_name: chebi_20-multimodal
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data_files:
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- split: train
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num_examples: 580
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download_size: 5021063
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dataset_size: 92999668.2
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- config_name: cav3_t-type_calcium_channels_butkiewicz-multimodal
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features:
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- name: IMAGE
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dtype: image
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- name: template
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dtype: string
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- name: template_original
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dtype: string
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- name: SMILES
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dtype: string
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- name: SMILES_ORIGINAL
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dtype: string
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- name: SELFIES
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dtype: string
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- name: InChI
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dtype: string
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- name: IUPAC
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dtype: string
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- name: split
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dtype: string
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- name: compound_id
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dtype: int64
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- name: activity_cav3_t_type_calcium_channels
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dtype: int64
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splits:
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- name: validation
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num_bytes: 4550404154.06
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num_examples: 269838
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- name: train
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num_bytes: 21798515255.43
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num_examples: 1290689
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- name: test
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num_bytes: 4878290266.4
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num_examples: 296020
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download_size: 2054737953
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dataset_size: 31227209675.89
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- config_name: chebi_20-multimodal
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features:
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- name: IMAGE
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path: carcinogens-multimodal/test-*
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- split: validation
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path: carcinogens-multimodal/validation-*
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+
- config_name: cav3_t-type_calcium_channels_butkiewicz-multimodal
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data_files:
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- split: validation
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path: cav3_t-type_calcium_channels_butkiewicz-multimodal/validation-*
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- split: train
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path: cav3_t-type_calcium_channels_butkiewicz-multimodal/train-*
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- split: test
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path: cav3_t-type_calcium_channels_butkiewicz-multimodal/test-*
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- config_name: chebi_20-multimodal
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data_files:
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- split: train
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cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00000-of-00010.parquet
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cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00001-of-00010.parquet
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cav3_t-type_calcium_channels_butkiewicz-multimodal/test-00002-of-00010.parquet
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