| .extractTemplatesFromData | Helper function to extract template profiles from user data |
| bootstrapIC50 | Bootstrap IC50 Estimates and Confidence Interval (ratio scale) |
| bootstrapIC50LogScale | Bootstrap IC50 Estimates and Confidence Interval (log scale) |
| convertGroupToNumericDose | Convert MSstats GROUP labels to numeric dose in nM and extract drug name |
| DIA_MSstats_Normalized | Example pre-processed DIA-MS dataset |
| doseResponseFit | Drug-protein interaction detection tested by F-test (fitted curve vs average response) |
| fitIsotonicRegression | Fit Isotonic Regression Model |
| futureExperimentSimulation | Test future experimental design using simulated data with user-defined or default templates |
| MSstatsPrepareDoseResponseFit | Prepare data for dose-response fitting with isotonic regression |
| plotHitRateMSstatsResponse | Plot hit rates by category |
| plotIsotonic | Plot Isotonic Regression Model |
| predictIC50 | Predict IC50 (dose where response = target) for each protein and drug |
| predictIC50Parallel | Parallel version of predictIC50 function |
| simulateChemoProteinLevelNonParametric | Simulate chemoproteomics data at the protein level - non-parametric approach |
| visualizeResponseProtein | Plot isotonic regression fit with optional IC50 for a single protein and drug |