@datagrok/pubchem-api v1.3.0
PubChemApi
PubChemApi is a package for the Datagrok platform that provides search capabilities in the PubChem database. Note that package queries external source, the structure you are searching with is sent to PubChem as a query parameter.
Features
Identity Search finds identical PubChem structures for the specified structure are identical to the provided chemical structure with different notions of chemical structure identity
Substructure Search finds PubChem structures for the specified substructure
Similarity Search finds similar PubChem structures for the specified structure
See also:
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