superstructure_search
Identify larger chemical compounds containing a specific query structure. Input a SMILES string to retrieve up to 10,000 results, aiding in chemical analysis and compound exploration through the PubChem database.
Instructions
Find larger compounds that contain the query structure
Input Schema
| Name | Required | Description | Default |
|---|---|---|---|
| max_records | No | Maximum number of results (1-10000, default: 100) | |
| smiles | Yes | SMILES string of the query structure |