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	1.	Vertical Ionization Energies and Electron Affinities of Native and Damaged DNA Bases, Nucleotides, and Pairs from Density Functional Theory Calculations: Model Assessment and Implications for DNA Damage Recognition and Repair. [electronic resource] by Diamantis, Polydefkis Tavernelli, Ivano Rothlisberger, Ursula Producer: 20190326 In: Journal of chemical theory and computation vol. 15 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Migration of small ligands in globins: Xe diffusion in truncated hemoglobin N. [electronic resource] by Diamantis, Polydefkis Unke, Oliver T Meuwly, Markus Producer: 20170424 In: PLoS computational biology vol. 13 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Effect of Single-Point Mutations on Nitric Oxide Rebinding and the Thermodynamic Stability of Myoglobin. [electronic resource] by Diamantis, Polydefkis Hage, Krystel El Meuwly, Markus Producer: 20200707 In: The journal of physical chemistry. B vol. 123 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Study of the redox properties of singlet and triplet Tris(2,2'-bipyridine)ruthenium(II) ([Ru(bpy)3]2+) in aqueous solution by full quantum and mixed quantum/classical molecular dynamics simulations. [electronic resource] by Diamantis, Polydefkis Gonthier, Jérôme Florian Tavernelli, Ivano Rothlisberger, Ursula Producer: 20150511 In: The journal of physical chemistry. B vol. 118 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	Pushing the frontiers of first-principles based computer simulations of chemical and biological systems. [electronic resource] by Brunk, Elizabeth Ashari, Negar Athri, Prashanth Campomanes, Pablo de Carvalho, F Franco Curchod, Basile F E Diamantis, Polydefkis Doemer, Manuel Garrec, Julian Laktionov, Andrey Micciarelli, Marco Neri, Marilisa Palermo, Giulia Penfold, Thomas J Vanni, Stefano Tavernelli, Ivano Rothlisberger, Ursula Producer: 20111220 In: Chimia vol. 65 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)