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Biochemistry

This page contains information about codes available on the HPCx system, which are widely used for the simulation of large biochemical systems.

• AMBER

• CHARMm

• DL_POLY

• GAMESS-UK
  • Marcus Durrant's report on using GAMESS-UK for in-silico simulations on HPCx

• NAMD

• GROMACS

• LAMMPS