59 |
|
#include "UseTheForce/DarkSide/fElectrostaticScreeningMethod.h" |
60 |
|
#include "UseTheForce/DarkSide/fSwitchingFunctionType.h" |
61 |
|
#include "UseTheForce/doForces_interface.h" |
62 |
+ |
#include "UseTheForce/DarkSide/neighborLists_interface.h" |
63 |
|
#include "UseTheForce/DarkSide/electrostatic_interface.h" |
64 |
|
#include "UseTheForce/DarkSide/switcheroo_interface.h" |
65 |
|
#include "utils/MemoryUtils.hpp" |
67 |
|
#include "selection/SelectionManager.hpp" |
68 |
|
#include "io/ForceFieldOptions.hpp" |
69 |
|
#include "UseTheForce/ForceField.hpp" |
70 |
+ |
|
71 |
|
|
72 |
|
#ifdef IS_MPI |
73 |
|
#include "UseTheForce/mpiComponentPlan.h" |
870 |
|
"succesfully sent the simulation information to fortran.\n"); |
871 |
|
MPIcheckPoint(); |
872 |
|
#endif // is_mpi |
873 |
+ |
|
874 |
+ |
// Setup number of neighbors in neighbor list if present |
875 |
+ |
if (simParams_->haveNeighborListNeighbors()) { |
876 |
+ |
setNeighbors(simParams_->getNeighborListNeighbors()); |
877 |
+ |
} |
878 |
+ |
|
879 |
+ |
|
880 |
|
} |
881 |
|
|
882 |
|
|