Research

My research background is in theoretical physics and chemistry. I have a master’s in theoretical physics from UCL, and spent a university internship researching theoretical chemistry at the Faraday Institution.

I’m a co-author of the two preprints below. Both are currently under review for publication.

Preprint · October 2026

LiveCoMS Roundtable: Discussing Markov state models after two decades of development v1.0

A roundtable on using Markov state models to interpret molecular dynamics simulations. Researchers offer distinct perspectives on best practices, limitations and extensions of the framework, rather than a single consensus view.

All authors

Daniel M. Zuckerman, Gregory R. Bowman, Amedeo Caflisch, Aaron R. Dinner, Ahmed Fadhluddin, Giuseppe Giangreco, Xuhui Huang, Bettina G. Keller, Stefan Klus, Feliks Nüske, Michael O’Connor, Edina Rosta, Christof Schütte, Gerhard Stock, Vincent Voelz, Jonathan Weare, Antonia S.J.S. Mey

Preprint · July 2026

Objective-Dependent Biasing of Markov Networks for Relaxation and First Passage

An investigation of how bias potentials affect molecular transition kinetics in Markov networks. The work compares biases designed for global relaxation with those targeting a specific transition, and examines how acceleration changes reaction pathways.

All authors

Qingying Wang, Ahmed Fadhluddin, Edina Rosta

Unpublished research · July 2021

Kinetic Network Analysis of COVID-19 Spread and Government Intervention in the UK

A stochastic kinetic network model of COVID-19 spread, calibrated to UK government data and incorporating different types of social contact. Simulations explored lockdowns, school closures, masks and vaccination, finding reduced transmission and, in some modelled scenarios, elimination of infection within the network.

Papers and posters available upon request.

Unpublished research

Role of Cation Identity in Local Order in Li2MOS Antiperovskite Cathode Materials

Research from my internship at the Faraday Institution.

DFT calculations and cluster expansion were used to study mixed iron–nickel Li2MOS antiperovskite cathodes. The results suggest that mixing entropy can stabilise nickel-rich compositions, potentially combining improved stability with higher voltage. The voltage benefit remains to be verified through further modelling and experiments.

Papers and posters available upon request.