---
dataset_info:
  features:
  - name: smiles
    dtype: string
  - name: canonsmiles
    dtype: string
  - name: isSmilesEqual
    dtype: bool
  - name: generic_scaffold
    dtype: string
  - name: scaffold
    dtype: string
  - name: rdkit_WT
    dtype: float64
  - name: rdkit_MR
    dtype: float64
  - name: rdkit_LogP
    dtype: float64
  - name: rdkit_HA
    dtype: float64
  - name: rdkit_HD
    dtype: float64
  - name: rdkit_NumAtoms
    dtype: float64
  - name: rdkit_TPSA
    dtype: float64
configs:
- config_name: default
  data_files:
  - split: train
    path: train/*/*.arrow
  - split: test
    path: test/*/*.arrow
- config_name: cls
  data_files:
  - split: train
    path: train/cls/*.arrow
  - split: test
    path: test/cls/*.arrow
- config_name: cno
  data_files:
  - split: train
    path: train/cno/*.arrow
  - split: test
    path: test/cno/*.arrow
- config_name: cn
  data_files:
  - split: train
    path: train/cn/*.arrow
  - split: test
    path: test/cn/*.arrow
- config_name: co
  data_files:
  - split: train
    path: train/co/*.arrow
  - split: test
    path: test/co/*.arrow
- config_name: g
  data_files:
  - split: train
    path: train/g/*.arrow
  - split: test
    path: test/g/*.arrow
- config_name: sk
  data_files:
  - split: train
    path: train/sk/*.arrow
  - split: test
    path: test/sk/*.arrow
task_categories:
- text-generation
- text2text-generation
- feature-extraction
tags:
- chemistry
size_categories:
- 1B<n<10B
---
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