DESCRIPTION
NAMESPACE
R/Utils_export.R
R/create_neg_PC.R
R/create_neg_PE.R
R/create_neg_PS.R
R/create_pos_PC.R
R/create_pos_PE.R
R/create_pos_PS.R
R/predict_spectra.R
inst/extdata/RefSpectra/maXis/neg/Cerd18_1_18_0_MHCOO_10eV.asc
inst/extdata/RefSpectra/maXis/neg/Cerd18_1_18_0_MHCOO_10eV.mgf
inst/extdata/RefSpectra/maXis/neg/Cerd18_1_18_0_MHCOO_20eV.asc
inst/extdata/RefSpectra/maXis/neg/Cerd18_1_18_0_MHCOO_20eV.mgf
inst/extdata/RefSpectra/maXis/neg/Cerd18_1_18_0_MHCOO_40eV.asc
inst/extdata/RefSpectra/maXis/neg/Cerd18_1_18_0_MHCOO_40eV.mgf
inst/extdata/RefSpectra/maXis/neg/GlcCerd18_1_18_0_MHCOO_10eV.asc
inst/extdata/RefSpectra/maXis/neg/GlcCerd18_1_18_0_MHCOO_10eV.mgf
inst/extdata/RefSpectra/maXis/neg/GlcCerd18_1_18_0_MHCOO_20eV.asc
inst/extdata/RefSpectra/maXis/neg/GlcCerd18_1_18_0_MHCOO_20eV.mgf
inst/extdata/RefSpectra/maXis/neg/GlcCerd18_1_18_0_MHCOO_40eV.asc
inst/extdata/RefSpectra/maXis/neg/GlcCerd18_1_18_0_MHCOO_40eV.mgf
inst/extdata/RefSpectra/maXis/neg/PC16_0_18_1_MHCOO_10eV.asc
inst/extdata/RefSpectra/maXis/neg/PC16_0_18_1_MHCOO_10eV.mgf
inst/extdata/RefSpectra/maXis/neg/PC16_0_18_1_MHCOO_20eV.asc
inst/extdata/RefSpectra/maXis/neg/PC16_0_18_1_MHCOO_20eV.mgf
inst/extdata/RefSpectra/maXis/neg/PC16_0_18_1_MHCOO_40eV.asc
inst/extdata/RefSpectra/maXis/neg/PC16_0_18_1_MHCOO_40eV.mgf
inst/extdata/RefSpectra/maXis/neg/PE16_0_18_1_MH_10eV.asc
inst/extdata/RefSpectra/maXis/neg/PE16_0_18_1_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/neg/PE16_0_18_1_MH_20eV.asc
inst/extdata/RefSpectra/maXis/neg/PE16_0_18_1_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/neg/PE16_0_18_1_MH_40eV.asc
inst/extdata/RefSpectra/maXis/neg/PE16_0_18_1_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/neg/PG16_0_18_1_MH_10eV.asc
inst/extdata/RefSpectra/maXis/neg/PG16_0_18_1_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/neg/PG16_0_18_1_MH_20eV.asc
inst/extdata/RefSpectra/maXis/neg/PG16_0_18_1_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/neg/PG16_0_18_1_MH_40eV.asc
inst/extdata/RefSpectra/maXis/neg/PG16_0_18_1_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/neg/PS16_0_18_1_MH_10eV.asc
inst/extdata/RefSpectra/maXis/neg/PS16_0_18_1_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/neg/PS16_0_18_1_MH_20eV.asc
inst/extdata/RefSpectra/maXis/neg/PS16_0_18_1_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/neg/PS16_0_18_1_MH_40eV.asc
inst/extdata/RefSpectra/maXis/neg/PS16_0_18_1_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/neg/SMd18_1_18_0_MHCOO_10eV.asc
inst/extdata/RefSpectra/maXis/neg/SMd18_1_18_0_MHCOO_10eV.mgf
inst/extdata/RefSpectra/maXis/neg/SMd18_1_18_0_MHCOO_20eV.asc
inst/extdata/RefSpectra/maXis/neg/SMd18_1_18_0_MHCOO_20eV.mgf
inst/extdata/RefSpectra/maXis/neg/SMd18_1_18_0_MHCOO_40eV.asc
inst/extdata/RefSpectra/maXis/neg/SMd18_1_18_0_MHCOO_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MH_10eV.asc
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MH_20eV.asc
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MH_40eV.asc
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MNa_10eV.asc
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MNa_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MNa_20eV.asc
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MNa_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MNa_40eV.asc
inst/extdata/RefSpectra/maXis/pos/Cerd18_1_18_0_MNa_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/GlcCerd18_1_18_0_MH_10eV.asc
inst/extdata/RefSpectra/maXis/pos/GlcCerd18_1_18_0_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/GlcCerd18_1_18_0_MH_20eV.asc
inst/extdata/RefSpectra/maXis/pos/GlcCerd18_1_18_0_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/GlcCerd18_1_18_0_MH_40eV.asc
inst/extdata/RefSpectra/maXis/pos/GlcCerd18_1_18_0_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MH_10eV.asc
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MH_20eV.asc
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MH_40eV.asc
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MNa_10eV.asc
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MNa_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MNa_20eV.asc
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MNa_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MNa_40eV.asc
inst/extdata/RefSpectra/maXis/pos/PC16_0_18_1_MNa_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MH_10eV.asc
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MH_20eV.asc
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MH_40eV.asc
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MNa_10eV.asc
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MNa_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MNa_20eV.asc
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MNa_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MNa_40eV.asc
inst/extdata/RefSpectra/maXis/pos/PE16_0_18_1_MNa_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MH_10eV.asc
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MH_20eV.asc
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MH_40eV.asc
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MNa_10eV.asc
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MNa_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MNa_20eV.asc
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MNa_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MNa_40eV.asc
inst/extdata/RefSpectra/maXis/pos/PG16_0_18_1_MNa_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MH_10eV.asc
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MH_20eV.asc
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MH_40eV.asc
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MNa_10eV.asc
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MNa_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MNa_20eV.asc
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MNa_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MNa_40eV.asc
inst/extdata/RefSpectra/maXis/pos/PS16_0_18_1_MNa_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MH_10eV.asc
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MH_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MH_20eV.asc
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MH_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MH_40eV.asc
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MH_40eV.mgf
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MNa_10eV.asc
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MNa_10eV.mgf
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MNa_20eV.asc
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MNa_20eV.mgf
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MNa_40eV.asc
inst/extdata/RefSpectra/maXis/pos/SMd18_1_18_0_MNa_40eV.mgf
inst/extdata/examples/inputLipids.txt
inst/extdata/examples/inputLipids.xlsx
inst/extdata/fragmentations.xlsx
inst/extdata/templates/Template_Cer_Pos_MH.txt
inst/extdata/templates/Template_PC_Neg.txt
inst/extdata/templates/Template_PC_Pos_MH.txt
inst/extdata/templates/Template_PC_Pos_MNa.txt
inst/extdata/templates/Template_PE_Neg_MH.txt
inst/extdata/templates/Template_PE_Pos_MH.txt
inst/extdata/templates/Template_PS_Neg_MH.txt
inst/extdata/templates/pos_PC_MH.txt
man/create_neg_PC_MFAH.Rd
man/create_neg_PC_MHAcH.Rd
man/create_neg_PE_MH.Rd
man/create_neg_PS_MH.Rd
man/create_pos_PC_MH.Rd
man/create_pos_PC_MNa.Rd
man/create_pos_PE_MH.Rd
man/create_pos_PE_MNa.Rd
man/create_pos_PS_MH.Rd
man/create_pos_PS_MNa.Rd
man/predict_spectra.Rd
man/writeMassBank.Rd
man/writeMgf.Rd
man/writeMsp.Rd
tests/testthat/test_create_PC.R
tests/testthat/test_create_PE.R
tests/testthat/test_create_PS.R
vignettes/.gitignore
vignettes/spectra-prediction.Rmd