Projects

Here are some of the projects I have worked on during my PhD and spare time

Shiny applications

• Calibration Helper - An application to construct calibration lists for use with mass spectrometry data. Live version here

• Method Digester - An application to read Bruker .method (XML) files for FTICR mass spectrometers. Live version here

• Kendrick Mass Defect Tool - An application to plot a Kendrick mass defect (KMD) plot. Live version here

• VKSim - An application to simulate various reactions on a van Krevelen diagram. Live version here

• InterLabStudy - Tool to compare DOM data from various laboratories to a standard molecular assignment. More details can be found on the InterLabStudy GitHub page