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Number of items: 7.

Wragg, Darren, Casini, Angela and Leoni, Stefano 2020. Harvesting free energy landscapes in biological systems. Presented at: International Conference on Bio and Nanomaterials, MSC Cruise, Mediterranean Sea, Italy, 28 Sept - 3 Oct 2019. Published in: Piotto, Stefano, Concilio, Simona, Sessa, Lucia and Rossi, Federico eds. Advances in Bionanomaterials II. Lecture Notes in Bioengineering Springer, pp. 64-77. 10.1007/978-3-030-47705-9_7

Wragg, Darren, de Almeida, Andreia, Casini, Angela and Leoni, Stefano 2019. Unveiling the mechanisms of aquaglyceroporin-3 water and glycerol permeation by metadynamics. Chemistry - A European Journal 25 (37) , pp. 8713-8718. 10.1002/chem.201902121

Wragg, Darren 2019. Novel computational methods for biomechanistic and metallodrug discovery. PhD Thesis, Cardiff University.
Item availability restricted.

Mósca, Andreia F., De Almeida, Andreia, Wragg, Darren, Martins, Ana P., Sabir, Farzana, Leoni, Stefano, Moura, Teresa F., Prista, Catarina, Casini, Angela and Soveral, Graça 2018. Molecular basis of Aquaporin-7 permeability regulation by pH. Cells 7 (11) , 207. 10.3390/cells7110207

Wragg, Darren, De Almeida, Andreia, Bonsignore, Riccardo, Kühn, Fritz E., Leoni, Stefano and Casini, Angela 2018. On the mechanism of Gold/NHC compounds binding to DNA G-quadruplexes: combined metadynamics and biophysical methods. Angewandte Chemie International Edition 57 (44) , pp. 14524-14528. 10.1002/anie.201805727

Rocard, Lou, Wragg, Darren, Jobbins, Samuel A., Luciani, Lorenzo, Leoni, Stefano, Wouters, Johan and Bonifazi, Davide 2018. Templated chromophore assembly on peptide scaffolds: a structural evolution. Chemistry - A European Journal , -. 10.1002/chem.201803205

De Almeida, Andreia, Mosca, Andreia F., Wragg, Darren, Wenzel, Margot, Kavanagh, Paul, Barone, Giampaolo, Leoni, Stefano, Soveral, Graca and Casini, Angela 2017. The mechanism of aquaporin inhibition by gold compounds elucidated by biophysical and computational methods. Chemical Communications 53 (27) , pp. 3830-3833. 10.1039/C7CC00318H

This list was generated on Thu Sep 29 06:02:42 2022 BST.