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Publications by David J. Wales

The Dynamics of Conformational Isomerization in Flexible Biomolecules. II. Simulating Isomerizations in a Supersonic Free Jet With Master Equation Dynamics

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
2004English

Dynamics and Thermodynamics of Supercooled Liquids and Glasses From a Model Energy Landscape

Physical Review B
2001English

Related publications

Probing Conformational Equilibria in Flexible Recognition by Molecular Dynamics and EPR

Biophysical Journal
Biophysics
2016English

MasterMSM: A Package for Constructing Master Equation Models of Molecular Dynamics

2019English

Conformational Dynamics in the GABAA Receptor

Biophysical Journal
Biophysics
2015English

Cavity Master Equation for the Continuous Time Dynamics of Discrete-Spin Models

Physical review. E
Nonlinear PhysicsProbabilityStatisticsCondensed Matter PhysicsStatistical
2017English

Covalent Dye Attachment Influences the Dynamics and Conformational Properties of Flexible Peptides

PLoS ONE
Multidisciplinary
2017English

Spotting the Difference in Molecular Dynamics Simulations of Biomolecules

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
2016English

Molecular Dynamics Simulations of Biomolecules

Accounts of Chemical Research
MedicineChemistry
2002English

Unraveling the Primary Isomerization Dynamics in Cyanobacterial Phytochrome Cph1 With Multipulse Manipulations

Journal of Physical Chemistry Letters
Materials ScienceNanotechnologyPhysicalTheoretical ChemistryNanoscience
2013English

Essential Dynamics of Reversible Peptide Folding: Memory-Free Conformational Dynamics Governed by Internal Hydrogen Bonds

Journal of Molecular Biology
Structural BiologyMolecular BiologyBiophysics
2001English

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