get.cmp.inf: Get compound information from ChEMBL

Description Usage Arguments Details Examples

Description

These functions allow one to retrieve compounds information from ChEMBL compounds are identified either by a ChEMBL ID or by a standard InChI key.

Usage

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get.cmp.inf(x, type = "chemblid")

Arguments

x

: String representing chemblid or standard InCHI key for the molecule.

type

: For get.compound, one of chemblid or stdinchi to indicate the nature of the molecule id.

Details

get.cmp.inf

Examples

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#get information for chembl compound id
get.compound("CHEMBL12")

#get information for standard inchi
get.compound("QFFGVLORLPOAEC-SNVBAGLBSA-N",type='stdinchi')

abhik1368/rUniChEMBL documentation built on May 10, 2019, 4:10 a.m.