--- trunk/OOPSE/libmdtools/Integrator.hpp 2004/01/27 19:15:20 987 +++ trunk/OOPSE/libmdtools/Integrator.hpp 2004/02/03 20:43:08 1010 @@ -479,7 +479,7 @@ class OOPSEMinimizerBase : public RealIntegrator { OOPSEMinimizerBase ( SimInfo *theInfo, ForceFields* the_ff ); virtual ~OOPSEMinimizerBase(); - double calcGradient(const vector& x, vector& grad); + double calcGradient(vector& x, vector& grad); void setOptCoor(vector& x); void getOptCoor(vector& x); void output();