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Journal of Chemical Theory and Computation|November 25, 2015
A New Coarse-Grained Force Field for Membrane-Peptide SimulationsZhe Wu, Qiang Cui, Arun YethirajThe Journal of Physical Chemistry. B|August 13, 2010
A new coarse-grained model for water: the importance of electrostatic interactionsZhe Wu, Qiang Cui, Arun YethirajThe Journal of Physical Chemistry. B|September 13, 2013
Why do arginine and lysine organize lipids differently? Insights from coarse-grained and atomistic simulationsZhe Wu, Qiang Cui, Arun YethirajProceedings of the National Academy of Sciences of the United States of America|April 5, 2023
Sensitive and selective polymer condensation at membrane surface driven by positive co-operativityZhuang Liu, Arun Yethiraj, Qiang CuiJournal of Chemical Theory and Computation|November 21, 2015
Free Energy Calculations for the Peripheral Binding of Proteins/Peptides to an Anionic Membrane. 1. Implicit Membrane ModelsLeili Zhang, Arun Yethiraj, Qiang CuiJournal of Chemical Theory and Computation|December 4, 2015
Establishing Effective Simulation Protocols for β- and α/β-Mixed Peptides. I. QM and QM/MM ModelsXiao Zhu, Arun Yethiraj, Qiang CuiProceedings of the National Academy of Sciences of the United States of America|October 5, 2017
Cavity hydration dynamics in cytochrome <i>c</i> oxidase and functional implicationsChang Yun Son, Arun Yethiraj, Qiang CuiThe Journal of Physical Chemistry. B|October 2, 2010
Sequence-dependent interaction of β-peptides with membranesJagannath Mondal, Xiao Zhu, Qiang Cui, et al.Biophysical Journal|May 6, 2009
A computational framework for mechanical response of macromolecules: application to the salt concentration dependence of DNA bendabilityLiang Ma, Arun Yethiraj, Xi Chen, et al.The Journal of Physical Chemistry. B|November 30, 2011
Sequence-dependent pKa shift induced by molecular self-assembly: insights from computer simulationJagannath Mondal, Xiao Zhu, Qiang Cui, et al.Pageof 132