build.METACYC: Build METACYC

Description Usage Arguments Details Value See Also

Description

Parses METACYC, returns data table with columns compoundname, description, charge, formula and structure (in SMILES)

Usage

1
build.METACYC(outfolder)

Arguments

outfolder

Which folder to save temp files to?

Details

Requires account creation! Then download SmartTable from 'https://metacyc.org/group?id=biocyc17-31223-3787684059#' as 'All_compounds_of_MetaCyc.txt' and save in the databases/metacyc_source folder.

Value

data table with parsed database

See Also

getURL str_match fread pbapply


MetaDBparse documentation built on May 3, 2021, 5:09 p.m.