Selected work
Projects & publications
Method-focused scientific case studies and peer-reviewed publications, filterable by research theme.
Enzyme Engineering for the Biosynthesis of Therapeutics
Exploring, characterising and evolving enzymes involved in the biosynthesis of therapeutically relevant molecules, with emphasis on selectivity, substrate scope and biocatalytic potential.
Computational and AI-Guided Drug Discovery
Using molecular modelling, docking, molecular dynamics, quantum chemistry and machine learning to explore therapeutic targets, predict molecular properties and support drug discovery workflows.
Molecular Mechanisms and Chemical Reactivity
Investigating how molecular structure controls chemical reactivity, selectivity and biological function through quantum chemistry, molecular modelling and mechanistic reasoning.
Membrane Proteins and Bacterial Nutrient Acquisition
Current work focuses on biochemical and biophysical approaches to understand mycobacterial nutrient acquisition and membrane-protein function.