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Plos One|March 3, 2012
Carbinolamine formation and dehydration in a DNA repair enzyme active siteM L Dodson, Ross C Walker, R Stephen LloydJournal of Computational Chemistry|October 15, 2013
An extensible interface for QM/MM molecular dynamics simulations with AMBERAndreas W Götz, Matthew A Clark, Ross C WalkerJournal of Molecular Recognition : JMR|September 29, 2018
pH-dependent conformational dynamics of beta-secretase 1: A molecular dynamics studyDaniel J Mermelstein, J Andrew McCammon, Ross C WalkerInternational Journal of Quantum Chemistry|February 12, 2010
A Partial Nudged Elastic Band Implementation for Use with Large or Explicitly Solvated SystemsChristina Bergonzo, Arthur J Campbell, Ross C Walker, et al.The Journal of Physical Chemistry. A|October 24, 2009
Are current semiempirical methods better than force fields? A study from the thermodynamics perspectiveGustavo de M Seabra, Ross C Walker, Adrian E RoitbergJournal of Chemical Theory and Computation|November 24, 2015
Application of Adaptive QM/MM Methods to Molecular Dynamics Simulations of Aqueous SystemsKyoyeon Park, Andreas W Götz, Ross C Walker, et al.Biophysical Journal|March 13, 2015
Speed of conformational change: comparing explicit and implicit solvent molecular dynamics simulationsRamu Anandakrishnan, Aleksander Drozdetski, Ross C Walker, et al.Cell Biochemistry and Biophysics|March 15, 2016
Single Active Site Mutation Causes Serious Resistance of HIV Reverse Transcriptase to Lamivudine: Insight from Multiple Molecular Dynamics SimulationsSuri Moonsamy, Soumendranath Bhakat, Ross C Walker, et al.Journal of Chemical Theory and Computation|August 20, 2014
Influence of Sequence and Covalent Modifications on Yeast tRNA DynamicsXiaoju Zhang, Ross C Walker, Eric M Phizicky, et al.The Journal of Physical Chemistry. B|August 25, 2012
LIPID11: a modular framework for lipid simulations using amberÅge A Skjevik, Benjamin D Madej, Ross C Walker, et al.Pageof 7