Description Usage Arguments Value Examples
View source: R/property_extractor.R
Extracts molecular properties for a compound of interest based on its PubChem CID using the PubChem REST API.
1 | property_extractor(pubchem_cid)
|
pubchem_cid |
A PubChem CID |
A tibble with CID, molecular formula, molecular weight, canonical SMILES, and InChIKey.
1 | property_extractor("5090")
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