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The Journal of Chemical Physics|August 20, 2014
Multiple branched adaptive steered molecular dynamicsGungor Ozer, Thomas Keyes, Stephen Quirk, et al.
Journal of Chemical Theory and Computation|November 26, 2015
Thermodynamics of Decaalanine Stretching in Water Obtained by Adaptive Steered Molecular Dynamics SimulationsGungor Ozer, Stephen Quirk, Rigoberto Hernandez
The Journal of Chemical Physics|June 16, 2012
Adaptive steered molecular dynamics: validation of the selection criterion and benchmarking energetics in vacuumGungor Ozer, Stephen Quirk, Rigoberto Hernandez
Journal of Chemical Theory and Computation|December 1, 2015
Adaptive Steered Molecular Dynamics of the Long-Distance Unfolding of Neuropeptide YGungor Ozer, Edward F Valeev, Stephen Quirk, et al.
Proteins|March 11, 2009
De novo identification of binding sequences for antibody replacement moleculesStephen Quirk, Shi Zhong, Rigoberto Hernandez
RSC Advances|May 2, 2022
The relative stability of trpzip1 and its mutants determined by computation and experimentHailey R Bureau, Stephen Quirk, Rigoberto Hernandez
Biochemistry|April 17, 2026
The Role of Metal Complexation in the Unfolding Energetics of a Nudix HydrolaseNicolas Alt, Yi Zhuang, Stephen Quirk, et al.
Journal of Chemical Theory and Computation|July 13, 2022
Implementation of Telescoping Boxes in Adaptive Steered Molecular DynamicsYi Zhuang, Nikhil Thota, Stephen Quirk, et al.
Biophysical Journal|September 19, 2006
Dihedral-angle information entropy as a gauge of secondary structure propensityShi Zhong, Jeremy M Moix, Stephen Quirk, et al.
Journal of Chemical Theory and Computation|March 2, 2016
Determining the Energetics of Small β-Sheet Peptides using Adaptive Steered Molecular DynamicsHailey R Bureau, Eli Hershkovits, Stephen Quirk, et al.
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