We have a high performance computational Linux cluster:
  • 30 IB nodes (each with a pair of quad core CPUs): Total of 720 cores.
  •  1 Nvidia Tesla K20 GPUs (2496 CUDA cores)
CHARMM c37b2 (script) for biomolecular simulations and simulation analysis
NAMD for bimolecular simulations
VMD (GUI) for Biomolecular graphics
GAMESS for QM and QM-MM simulations
Accelrys Discovery Studio 3.1 for molecular modeling