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Number of items: 7.

Wragg, Darren, Casini, Angela ORCID: and Leoni, Stefano ORCID: 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 ORCID:, Casini, Angela ORCID: and Leoni, Stefano ORCID: 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 ORCID:, Wragg, Darren, Martins, Ana P., Sabir, Farzana, Leoni, Stefano ORCID:, Moura, Teresa F., Prista, Catarina, Casini, Angela ORCID: 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 ORCID:, Bonsignore, Riccardo ORCID:, Kühn, Fritz E., Leoni, Stefano ORCID: and Casini, Angela ORCID: 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 ORCID:, Wouters, Johan and Bonifazi, Davide ORCID: 2018. Templated chromophore assembly on peptide scaffolds: a structural evolution. Chemistry - A European Journal , -. 10.1002/chem.201803205

De Almeida, Andreia ORCID:, Mosca, Andreia F., Wragg, Darren, Wenzel, Margot ORCID:, Kavanagh, Paul, Barone, Giampaolo, Leoni, Stefano ORCID:, Soveral, Graca and Casini, Angela ORCID: 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 Tue Apr 16 07:40:06 2024 BST.