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The Journal of Physical Chemistry. B|May 21, 2009
Molecular dynamics simulations of equilibrium and transport properties of amino acid-based room temperature ionic liquidsAndrew Sirjoosingh, Saman Alavi, Tom K WooJournal of Chemical Theory and Computation|December 4, 2015
Electrostatic Potential Derived Atomic Charges for Periodic Systems Using a Modified Error FunctionalCarlos Campañá, Bastien Mussard, Tom K WooThe Journal of Chemical Physics|February 1, 2016
Molecular simulations and density functional theory calculations of bromine in clathrate hydrate phasesHana Dureckova, Tom K Woo, Saman AlaviJournal of Physics. Condensed Matter : an Institute of Physics Journal|March 16, 2011
Grain boundary sliding in irradiated stressed Fe-Ni bicrystals: a molecular dynamics studyEric Beamish, Carlos Campañá, Tom K WooThe Journal of Chemical Physics|June 21, 2006
Effects of Zr doping on stoichiometric and reduced ceria: a first-principles studyZongxian Yang, Tom K Woo, Kersti HermanssonJournal of Chemical Information and Modeling|December 2, 2020
Benchmarking Force Field and the ANI Neural Network Potentials for the Torsional Potential Energy Surface of Biaryl Drug FragmentsShae-Lynn J Lahey, Tu Nguyen Thien Phuc, Christopher N RowleyThe Journal of Physical Chemistry. B|June 8, 2018
Evaluating the London Dispersion Coefficients of Protein Force Fields Using the Exchange-Hole Dipole Moment ModelEvan T Walters, Mohamad Mohebifar, Erin R Johnson, et al.Current Opinion in Structural Biology|February 12, 2020
Polarisable force fields: what do they add in biomolecular simulations?Vs Sandeep Inakollu, Daan P Geerke, Christopher N Rowley, et al.The Journal of Physical Chemistry. B|August 21, 2024
Modeling Intermolecular Interactions with Exchange-Hole Dipole Moment Dispersion Corrections to Neural Network PotentialsNguyen Thien Phuc Tu, Siri Williamson, Erin R Johnson, et al.The Journal of Physical Chemistry. B|October 1, 2015
Polarizable Force Field with a σ-Hole for Liquid and Aqueous BromomethaneArchita N S Adluri, Jennifer N Murphy, Tiffany Tozer, et al.Pageof 12