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Nanoscale Advances|November 2, 2022
Design of self-assembling mesoscopic Goldberg polyhedraIstvan Horvath, David J Wales, Szilard N FejerThe Journal of Chemical Physics|August 2, 2024
Energy landscapes for clusters of hexapeptidesNicy, John W R Morgan, David J WalesThe Journal of Chemical Physics|May 10, 2013
Communication: Certifying the potential energy landscapeDhagash Mehta, Jonathan D Hauenstein, David J WalesACS Nano|January 9, 2010
Emergent complexity from simple anisotropic building blocks: shells, tubes, and spiralsSzilard N Fejer, Dwaipayan Chakrabarti, David J WalesThe Journal of Physical Chemistry. B|December 6, 2018
Computational Investigation of RNA A-Bulges Related to the Microtubule-Associated Protein Tau Causing Frontotemporal Dementia and ParkinsonismDavid J Wales, Matthew D Disney, Ilyas YildirimThe Journal of Chemical Physics|March 24, 2016
Quantum tunneling splittings from path-integral molecular dynamicsEdit Mátyus, David J Wales, Stuart C AlthorpeJournal of Chemical Theory and Computation|November 24, 2015
A Local Rigid Body Framework for Global Optimization of BiomoleculesHalim Kusumaatmaja, Chris S Whittleston, David J WalesThe Journal of Chemical Physics|January 11, 2005
Archetypal energy landscapes: dynamical diagnosisFlorin Despa, David J Wales, R Stephen BerryThe Journal of Physical Chemistry. B|August 7, 2018
Computational Studies of the Mechanical Stability for Single-Strand Break DNAPaweł Krupa, David J Wales, Adam K SieradzanJournal of Chemical Theory and Computation|December 13, 2018
Energy Landscape for Fold-Switching in Regulatory Protein RfaHJerelle A Joseph, Debayan Chakraborty, David J WalesPageof 26