--- trunk/mdtools/md_code/Symplectic.cpp 2002/10/11 15:09:09 134 +++ trunk/mdtools/md_code/Symplectic.cpp 2002/11/21 20:33:06 184 @@ -4,8 +4,8 @@ #include "Integrator.hpp" #include "Thermo.hpp" #include "ReadWrite.hpp" +#include "simError.h" - extern "C"{ void v_constrain_a_( double &dt, int &n_atoms, double* mass, @@ -147,7 +147,12 @@ void Symplectic::integrate( void ){ StatWriter* e_out = new StatWriter( entry_plug ); DumpWriter* dump_out = new DumpWriter( entry_plug ); + strcpy( checkPointMsg, "Fast foward!" ); + MPIcheckPoint(); + strcpy( checkPointMsg, "Fast fowarding!" ); + MPIcheckPoint(); + Atom** atoms = entry_plug->atoms; DirectionalAtom* dAtom; dt2 = 0.5 * dt;