Cluster

Hardware

Dell computer (2012) mounted to HP cluster

64 cpu core 1x62 AMD Opteron(tm) Processor 6274 computing processor 1x62GB standard system memory


Dell computers (2011) mounted to HP cluster

240 cpu core 5x48 AMD Opteron(tm) Processor 6168 computing processors 5x126GB standard system memory


SGI computers (2010) mounted to HP cluster

128 cpu core 4x32 AMD Opteron(tm) Processor 6134 computing processors 4x32GB standard system memory


HP Blade Cluster (2009)

128 cpu core 16x2x4 Intel Xeon E5420 computing nodes 16x8GB standard system memory

Software

Software environment

Dalton

Gaussian

Molpro

MMC

NAMD

Kállay's MRCC code

Amber

AMBER GPU

DESMOND

GROMACS

VMD

SCHRODINGER

MOLGEN