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How Thioredoxin Dissociates Its Mixed DisulfideRoos, Goedele; Foloppe, Nicolas; Van Laer, Koen; Wyns, Lode; Nilsson, Lennart; Geerlings, Paul; Messens, Joris; Böckmann, Rainer A. · PLoS Computational Biology · 2009
Intrinsic Relative Stabilities of the Neutral Tautomers of Arginine Side-Chain ModelsNorberg, Jan; Foloppe, Nicolas; Nilsson, Lennart · Journal of Chemical Theory and Computation · 2005
Toward a Full Characterization of Nucleic Acid Components in Aqueous Solution: Simulations of NucleosidesFoloppe, Nicolas; Nilsson, Lennart · The Journal of Physical Chemistry B · 2005
Intrinsic Conformational Energetics Associated with the Glycosyl Torsion in DNA: A Quantum Mechanical StudyFoloppe, Nicolas; Hartmann, Brigitte; Nilsson, Lennart; MacKerell, Alexander D. · Biophysical Journal · 2002
Motions and Entropies in Proteins as Seen in NMR Relaxation Experiments and Molecular Dynamics SimulationsAllnér, Olof; Foloppe, Nicolas; Nilsson, Lennart · The Journal of Physical Chemistry B · 2015
Virtual screening, selection and development of a benzindolone structural scaffold for inhibition of lumazine synthaseArindam Talukdar; Ekaterina Morgunova; Jianxin Duan; Winfried Meining; Nicolas Foloppe; Lennart Nilsson; Adelbert Bacher; Boris Illarionov; Markus Fischer; Rudolf Ladenstein; Mark Cushman · 2010
Ab initio conformational analysis of nucleic acid components: Intrinsic energetic contributions to nucleic acid structure and dynamicsNicolas Foloppe; Lennart Nilsson; Alexander D. MacKerell Jr. · 2001