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Journal of Chemical Theory and Computation|April 26, 2024
100 Years of the Lennard-Jones PotentialPeter Schwerdtfeger, David J WalesThe Journal of Chemical Physics|April 1, 2019
Dynamics of an adenine-adenine RNA conformational switch from discrete path samplingDebayan Chakraborty, David J WalesThe Journal of Chemical Physics|October 2, 2020
Fragility and correlated dynamics in supercooled liquidsAtreyee Banerjee, David J WalesProceedings of the National Academy of Sciences of the United States of America|December 31, 2013
Observation time scale, free-energy landscapes, and molecular symmetryDavid J Wales, Peter SalamonThe Journal of Physical Chemistry. B|May 26, 2018
Evolved Minimal Frustration in Multifunctional BiomoleculesKonstantin Röder, David J WalesThe Journal of Physical Chemistry Letters|December 15, 2017
Energy Landscape and Pathways for Transitions between Watson-Crick and Hoogsteen Base Pairing in DNADebayan Chakraborty, David J WalesPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|July 23, 2008
Energy landscape of a model discotic liquid crystalDwaipayan Chakrabarti, David J WalesThe Journal of Chemical Physics|April 26, 2005
Protonated water clusters described by an empirical valence bond potentialTim James, David J WalesThe Journal of Chemical Physics|October 5, 2013
Energy landscapes and global thermodynamics for alanine peptidesSandeep Somani, David J WalesThe Journal of Chemical Physics|July 17, 2020
A well-behaved theoretical framework for ReaxFF reactive force fieldsDavid Furman, David J WalesPageof 25