John E. Stone Jan Saam David J. Hardy Kirby L. Vandivort Wen-mei W. Hwu Klaus Schulten High performance computation and interactive display of molecular orbitals on GPUs and multi-core CPUs. 9-18 2009 GPGPU http://doi.acm.org/10.1145/1513895.1513897 conf/asplos/2009gpgpu db/conf/asplos/gpgpu2009.html#StoneSHVHS09