Publications by authors named "Slimane Doudou"

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Atomistic simulations of calcium uranyl(VI) carbonate adsorption on calcite and stepped-calcite surfaces.
Slimane Doudou, David J Vaughan, Francis R Livens, Neil A Burton

Environ Sci Technol· July 2012

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Investigation of ligand exchange reactions in aqueous uranyl carbonate complexes using computational approaches.
Slimane Doudou, Krishnamoorthy Arumugam, David J Vaughan, Francis R Livens, Neil A Burton

Phys Chem Chem Phys· June 2011

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The effects of perfluorination on carbohydrate-pi interactions: computational studies of the interaction of benzene and hexafluorobenzene with fucose and cyclodextrin.
Rajesh K Raju, Ian H Hillier, Neil A Burton, Mark A Vincent, Slimane Doudou

Phys Chem Chem Phys· July 2010

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Inhibitors of PIM-1 kinase: a computational analysis of the binding free energies of a range of imidazo [1,2-b] pyridazines.
Slimane Doudou, Raman Sharma, Richard H Henchman, David W Sheppard, Neil A Burton

J Chem Inf Model· March 2010

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Standard Free Energy of Binding from a One-Dimensional Potential of Mean Force.
Slimane Doudou, Neil A Burton, Richard H Henchman

J Chem Theory Comput· April 2009

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