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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
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Wragg, Darren 2019. Novel computational methods for biomechanistic and metallodrug discovery. PhD Thesis, Cardiff University.
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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
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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
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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
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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
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This list was generated on Wed Oct 21 04:03:18 2020 BST.