Andrea Townsend-Nicholson

Computational Methods Used in Hit-to-Lead and Lead Optimization Stages of Structure-Based Drug Discovery.

Alexander Heifetz, Michelle Southey, Inaki Morao, 2018, Methods in molecular biology.

An Ensemble-Based Protocol for the Computational Prediction of Helix–Helix Interactions in G Protein-Coupled Receptors using Coarse-Grained Molecular Dynamics

Peter V Coveney, David W Wright, Andrea Townsend-Nicholson, 2017, Journal of chemical theory and computation.

Cell electrospinning: a unique biotechnique for encapsulating living organisms for generating active biological microthreads/scaffolds.

Suwan N Jayasinghe, Andrea Townsend-Nicholson, S. Jayasinghe, 2006, Biomacromolecules.

Ensemble-Based Steered Molecular Dynamics Predicts Relative Residence Time of A2A Receptor Binders.

Peter V Coveney, Fouad S. Husseini, Alexander Heifetz, 2019, Journal of chemical theory and computation.

Bio-electrosprays: the next generation of electrified jets.

Suwan N Jayasinghe, Andrea Townsend-Nicholson, 2006, Biotechnology journal.

Hit-to-lead and lead optimization binding free energy calculations for G protein-coupled receptors

Peter V. Coveney, Maciej Malawski, David W. Wright, 2020, Interface Focus.

Educating and engaging new communities of practice with high performance computing through the integration of teaching and research

Andrea Townsend-Nicholson, 2020, Interface Focus.