Ross C. Walker

Scott Le Grand, Andreas W. Götz, Ross C. Walker: SPFP: Speed without compromise - A mixed precision model for GPU accelerated molecular dynamics simulations. Computer Physics Communications 184(2): 374-380 (2013)

C. David Sherrill, Bobby G. Sumpter, Mutasem O. Sinnokrot, Michael S. Marshall, Edward G. Hohenstein, Ross C. Walker, Ian R. Gould: Assessment of standard force field models against high-quality ab initio potential curves for prototypes of pi-pi, CH/pi, and SH/pi interactions. Journal of Computational Chemistry 30(14): 2187-2193 (2009)

Srivatsan Raman, Bin Qian, David Baker, Ross C. Walker: Advances in Rosetta protein structure prediction on massively parallel systems. IBM Journal of Research and Development 52(1-2): 7-18 (2008)

Ross C. Walker, Michael F. Crowley, David A. Case: The implementation of a fast and accurate QM/MM potential method in Amber. Journal of Computational Chemistry 29(7): 1019-1031 (2008)

Ross C. Walker, Ian P. Mercer, Ian R. Gould, David R. Klug: Comparison of basis set effects and the performance of ab initio and DFT methods for probing equilibrium fluctuations. Journal of Computational Chemistry 28(2): 478-490 (2007)

Ross C. Walker, Srivatsan Raman, David Baker: Poster reception - High resolution, high throughput protein structure prediction using IBM Blue Gene supercomputers: predicting CASP targets in record time. SC 2006: 165