ChemTEB Pair Classification Datasets
Collection
Chemical Pair Classification Datasets for Evaluating Text Embedding Models • 10 items • Updated
Dataset Viewer
The dataset viewer is not available for this dataset.
Unexpected token '<', "<html>
<h"... is not valid JSON
Need help to make the dataset viewer work? Make sure to review how to configure the dataset viewer, and open a discussion for direct support.
CoconutDB SMILES to Formula Pair Classification
This dataset contains pairs of SMILES strings (both isomeric and canonical) and their corresponding molecular formulas, with labels indicating whether they refer to the same chemical entity. A label of 1 means the SMILES string and the molecular formula correspond to the same entity, while a label of 0 indicates they do not. The dataset is sourced from CoconutDB and provides valuable information for tasks involving chemical entity matching and molecular formula analysis.
- Downloads last month
- 17