Paper accepted | JCTC

Contact-Map-Driven Exploration of Heterogeneous Protein-Folding……


Paper accepted | Int. J. Pharm

Unravelling the interactions between small molecules and liposomal…


Paper accepted | Journal of Chemical Physics

Combining machine learning and molecular simulations to predict the…


Paper accepted | Faraday Discussions

Understanding the impact of ammonium ion substitutions on…


The Big Bang Fair - 2023

We have done quite a lot in terms of Outreach, this year, but nothing comes…


Paper accepted | Journal of Chemical Physics

Interplay of multiple clusters and initial interface positioning for…


Paper accepted | Journal of Chemical Information and Modeling

Generating protein folding trajectories Using contact-map-driven…


Crystallisation Day

  With the new year, we wanted to put together an Outreach activity that…


Paper accepted | Nature Communications

Understanding the emergence of the boson peak in molecular glasses……