| binMS | Consolidate mass spectrometry observations |
| bioact | Bioactivity data |
| extractMS | Extract embedded mass spectrometry data |
| extract_ranked | Extract candidate compounds |
| filterMS | Filter compounds from mass spectrometry data |
| mass_spec | Mass spectrometry data |
| msDat | Constructor for class 'msDat' |
| print.filterMS | Basic information for class 'filterMS' |
| print.msDat | Print method for class 'msDat' |
| print.rankEN | Basic information for class 'rankEN' |
| rankEN | Rank compounds via the Elastic Net path |
| summary.binMS | Overview of the binning process |
| summary.filterMS | Overview of the filtering process |
| summary.rankEN | Overview of the elastic net selection process |