Files in shutinet/metabSeek
Search in several databases metabolites masses or spectras
.Rbuildignore
.gitattributes
DESCRIPTION
LICENSE.md
NAMESPACE
R/FUN.R
R/chem_FUN.R
R/generate_db.R
R/global.R
R/launch_app.R
R/query_db.R
README.md
data-raw/chebi.sdf
data/adducts_df.rda
data/isotopes_df.rda
inst/extdata/database.sqlite
inst/shiny_app/rsconnect/shinyapps.io/driveshaft/shiny_app.dcf
inst/shiny_app/server.R
inst/shiny_app/ui.R
inst/shiny_app/www/func.js
inst/shiny_app/www/smiles-drawer.min.js
inst/shiny_app/www/style.css
man/adducts_df.Rd
man/build_db.Rd
man/cbind_forced.Rd
man/check_args.Rd
man/check_cas.Rd
man/check_inchikey.Rd
man/check_inputs.Rd
man/format_db.Rd
man/format_formula.Rd
man/format_inchikey.Rd
man/format_int.Rd
man/format_text.Rd
man/get_CHEBI_db.Rd
man/get_basepeak_mass.Rd
man/get_mass_range.Rd
man/grapes-not-in-grapes.Rd
man/havingIP.Rd
man/hit_mzs.Rd
man/isotopes_df.Rd
man/launch_app.Rd
man/mzs_to_mass.Rd
man/na_row_omit.Rd
man/shiny_error.Rd
man/shiny_valid.Rd
man/try_it.Rd
tests/testthat.R
tests/testthat/test-FUN.R
tests/testthat/test-chem_FUN.R
tests/testthat/test-query_db.R
