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The Journal of Physical Chemistry. B|December 2, 2015
Pathways through Equilibrated States with Coexisting Phases for Gas Hydrate FormationEdyta Małolepsza, Tom KeyesJournal of Chemical Theory and Computation|December 9, 2015
Water Freezing and Ice MeltingEdyta Małolepsza, Tom KeyesThe Journal of Physical Chemistry. B|September 24, 2015
Isobaric Molecular Dynamics Version of the Generalized Replica Exchange Method (gREM): Liquid-Vapor EquilibriumEdyta Małolepsza, Maxim Secor, Tom KeyesPhysical Review Letters|May 16, 2015
Entropic Description of Gas Hydrate Ice-Liquid Equilibrium via Enhanced Sampling of Coexisting PhasesEdyta Małolepsza, Jaegil Kim, Tom KeyesThe Journal of Physical Chemistry. B|March 25, 2014
Empirical maps for the calculation of amide I vibrational spectra of proteins from classical molecular dynamics simulationsEdyta Małolepsza, John E StraubThe Journal of Physical Chemistry. A|April 14, 2007
Comparison of geometric, electronic, and vibrational properties for isomers of small fullerenes C20-C36Edyta Małolepsza, Henryk A Witek, Stephan IrleThe Journal of Physical Chemistry. B|March 22, 2012
Dynamics of methionine ligand rebinding in cytochrome cPing Zhang, Edyta Małolepsza, John E StraubProceedings of the National Academy of Sciences of the United States of America|May 25, 2005
Theoretical model of prion propagation: a misfolded protein induces misfoldingEdyta Małolepsza, Michal Boniecki, Andrzej Kolinski, et al.The Journal of Physical Chemistry. B|October 23, 2014
Role of Charge and Solvation in the Structure and Dynamics of Alanine-Rich Peptide AKA2 in AOT Reverse MicellesAnna Victoria Martinez, Edyta Małolepsza, Laura Domínguez, et al.The Journal of Chemical Physics|December 16, 2014
Exploring the role of hydration and confinement in the aggregation of amyloidogenic peptides Aβ(16-22) and Sup35(7-13) in AOT reverse micellesAnna Victoria Martinez, Edyta Małolepsza, Eva Rivera, et al.Pageof 3