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Proceedings of the National Academy of Sciences of the United States of America|April 13, 2016
Dynamical network of residue-residue contacts reveals coupled allosteric effects in recognition, catalysis, and mutationUrmi Doshi, Michael J Holliday, Elan Z Eisenmesser, et al.Proceedings of the National Academy of Sciences of the United States of America|March 28, 2012
Resolving the complex role of enzyme conformational dynamics in catalytic functionUrmi Doshi, Lauren C McGowan, Safieh Tork Ladani, et al.The Journal of Chemical Physics|July 24, 2008
A statistical analysis of the precision of reweighting-based simulationsTongye Shen, Donald HamelbergProteins|December 20, 2014
Loss of intramolecular electrostatic interactions and limited conformational ensemble may promote self-association of cis-tau peptideArghya Barman, Donald HamelbergBiochemistry|May 21, 2014
Cysteine-mediated dynamic hydrogen-bonding network in the active site of Pin1Arghya Barman, Donald HamelbergRNA (New York, N.Y.)|October 26, 2010
Deciphering the role of glucosamine-6-phosphate in the riboswitch action of glmS ribozymeYao Xin, Donald HamelbergThe Journal of Physical Chemistry. B|April 15, 2016
Coupled Dynamics and Entropic Contribution to the Allosteric Mechanism of Pin1Arghya Barman, Donald HamelbergBiochemistry|August 22, 2017
Redox-Specific Allosteric Modulation of the Conformational Dynamics of κB DNA by Pirin in the NF-κB Supramolecular ComplexCharles Adeniran, Donald HamelbergACS Omega|August 29, 2019
Fe(II)/Fe(III) Redox Process Can Significantly Modulate the Conformational Dynamics and Electrostatics of Pirin in NF-κB RegulationArghya Barman, Donald HamelbergJournal of the American Chemical Society|June 17, 2004
Standard free energy of releasing a localized water molecule from the binding pockets of proteins: double-decoupling methodDonald Hamelberg, J Andrew McCammonPageof 11