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The Journal of Physical Chemistry. A|November 26, 2013
Characterizing the catalyzed hydrolysis of β-1,4 glycosidic bonds using density functional theoryKelly L Fleming, Jim PfaendtnerACS Applied Materials & Interfaces|February 15, 2021
Effect of Fluoroethylene Carbonate Additives on the Initial Formation of the Solid Electrolyte Interphase on an Oxygen-Functionalized Graphitic Anode in Lithium-Ion BatteriesNadia N Intan, Jim PfaendtnerACS Chemical Biology|March 23, 2013
Structure, dynamics, and activity of xylanase solvated in binary mixtures of ionic liquid and waterVance W Jaeger, Jim PfaendtnerChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|August 8, 2007
Contra-thermodynamic behavior in intermolecular hydrogen transfer of alkylperoxy radicalsJim Pfaendtner, Linda J BroadbeltACS Nano|November 9, 2023
Role of Surface Features on the Initial Dissolution of CH3NH3PbI3 Perovskite in Liquid Water: An Ab Initio Molecular Dynamics StudyNadia N Intan, Jim PfaendtnerJournal of Chemical Theory and Computation|April 3, 2018
Lifting the Curse of Dimensionality on Enhanced Sampling of Reaction Networks with Parallel Bias MetadynamicsChristopher D Fu, Jim PfaendtnerThe Journal of Physical Chemistry. B|November 5, 2016
Destabilization of Human Serum Albumin by Ionic Liquids Studied Using Enhanced Molecular Dynamics SimulationsVance W Jaeger, Jim PfaendtnerThe Journal of Physical Chemistry. B|September 20, 2016
Chain Flexibility in Self-Assembled Monolayers Affects Protein Adsorption and Surface Hydration: A Molecular Dynamics StudyWesley Beckner, Yi He, Jim PfaendtnerMethods in Molecular Biology (Clifton, N.J.)|October 22, 2014
Tackling sampling challenges in biomolecular simulationsAlessandro Barducci, Jim Pfaendtner, Massimiliano BonomiJournal of Chemical Theory and Computation|November 22, 2015
Efficient Simulation of Explicitly Solvated Proteins in the Well-Tempered EnsembleMichael Deighan, Massimiliano Bonomi, Jim PfaendtnerPageof 23