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Biophysical Chemistry|October 9, 2020
Using quantum chemistry to estimate chemical shifts in biomoleculesDavid A CaseBMC Bioinformatics|October 11, 2008
Homology modelling of protein-protein complexes: a simple method and its possibilities and limitationsGuillaume Launay, Thomas SimonsonBiochemistry|November 27, 2008
Binding of tetracyclines to elongation factor Tu, the Tet repressor, and the ribosome: a molecular dynamics simulation studyAlexey Aleksandrov, Thomas SimonsonProtein Engineering, Design & Selection : PEDS|October 25, 2023
Enzyme redesign and genetic code expansionVaitea Opuu, Thomas SimonsonThe Journal of Physical Chemistry. B|July 21, 2006
A residue-pairwise generalized born scheme suitable for protein design calculationsGeorgios Archontis, Thomas SimonsonBiochemistry|December 15, 2011
Conformational selection by the aIF2 GTPase: a molecular dynamics study of functional pathwaysPriyadarshi Satpati, Thomas SimonsonBMC Structural Biology|November 21, 2007
Neutral evolution of protein-protein interactions: a computational study using simple modelsJosselin Noirel, Thomas SimonsonJournal of Computational Chemistry|January 3, 2013
Simulating GTP:Mg and GDP:Mg with a simple force field: a structural and thermodynamic analysisThomas Simonson, Priyadarshi SatpatiJournal of Computational Chemistry|October 15, 2013
Monte Carlo simulations of proteins at constant pH with generalized Born solvent, flexible sidechains, and an effective dielectric boundarySavvas Polydorides, Thomas SimonsonJournal of Computational Chemistry|May 24, 2014
Pairwise decomposition of an MMGBSA energy function for computational protein designThomas Gaillard, Thomas SimonsonPageof 28