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The 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 PfaendtnerAccounts of Chemical Research|September 26, 2017
A Multiscale Description of Biomolecular Active Matter: The Chemistry Underlying Many Life ProcessesGregory A VothThe 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 PfaendtnerAccounts of Chemical Research|February 24, 2006
Computer simulation of proton solvation and transport in aqueous and biomolecular systemsGregory A VothFrontiers in Bioscience : a Journal and Virtual Library|September 6, 2003
The computer simulation of proton transport in biomolecular systemsGregory A VothMethods 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 PfaendtnerBiophysical Journal|February 19, 2015
Comparison of three ionic liquid-tolerant cellulases by molecular dynamicsVance Jaeger, Patrick Burney, Jim PfaendtnerThe Journal of Physical Chemistry. B|March 15, 2021
Analyzing the Long Time-Scale Dynamics of Uremic Toxins Bound to Sudlow Site II in Human Serum AlbuminJames Ludwig, Josh Smith, Jim PfaendtnerThe Journal of Chemical Physics|October 9, 2021
Effect of graphitic anode surface functionalization on the structure and dynamics of electrolytes at the interfaceSabiha Rustam, Nadia N Intan, Jim PfaendtnerPageof 60