Simpatico is a C++ package for Monte Carlo (MC), Molecular Dynamics (MD) and hybrid MD/MC simulations of classical mechanical models of polymeric and molecular liquids. The package contains:
- Programs for Monte Carlo (MC) and molecular dynamics (MD) simulations on a single processor, named mcSim and mdSim.
- A program for parallel MD simulations, named ddSim.
Documentation:
Complete user and developer documentation is available here.