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Structure (London, England : 1993)|December 10, 2013
Eppur si muove! The 2013 Nobel Prize in ChemistryJeremy C Smith, Benoît RouxThe Journal of Physical Chemistry. B|March 17, 2006
Temperature-dependent protein dynamics: a simulation-based probabilistic diffusion-vibration Langevin descriptionKei Moritsugu, Jeremy C SmithPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|February 21, 2006
Pressure-dependent transition in protein dynamics at about revealed by molecular dynamics simulationLars Meinhold, Jeremy C SmithPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|March 15, 2003
Energy resolution and dynamical heterogeneity effects on elastic incoherent neutron scattering from molecular systemsTorsten Becker, Jeremy C SmithJournal of Computational Chemistry|August 5, 2008
A molecular mechanics force field for ligninLoukas Petridis, Jeremy C SmithProceedings of the National Academy of Sciences of the United States of America|September 25, 2019
Generation of the configurational ensemble of an intrinsically disordered protein from unbiased molecular dynamics simulationUtsab R Shrestha, Puneet Juneja, Qiu Zhang, et al.Journal of Chemical Theory and Computation|December 19, 2024
Absolute and Relative Binding Free Energy Calculations of Nucleotides to Multiple Protein ClassesApoorva Purohit, Xiaolin ChengJournal of Chemical Theory and Computation|October 13, 2025
Benchmarking Alchemical Relative Binding Free Energy Calculations for Nucleotide Binding to Multimeric ATPasesApoorva Purohit, Xiaolin ChengMethods in Molecular Biology (Clifton, N.J.)|September 26, 2012
Molecular dynamicsXiaolin Cheng, Ivaylo IvanovJournal of Computer-Aided Molecular Design|February 24, 2021
Peptide nucleic acid Hoogsteen strand linker design for major groove recognition of DNA thymine basesChristopher M Topham, Jeremy C SmithPageof 48