MetaDBparse (version 2.0.0)

build.RMDB: Build RMDB (deprecated)

Description

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

Usage

build.RMDB(outfolder, testMode = FALSE)

Arguments

outfolder

Which folder to save temp files to?

testMode

run in test mode? Only parses first ten compounds

Value

Message that RMDB is deprecated

Examples

# NOT RUN {
build.RMDB(outfolder=tempdir(), testMode=TRUE)
# }