| 50 |  | #include "UseTheForce/ForceField.hpp" | 
| 51 |  | #include "utils/simError.h" | 
| 52 |  | #include "UseTheForce/DarkSide/atype_interface.h" | 
| 53 | + | #include "UseTheForce/DarkSide/fForceOptions_interface.h" | 
| 54 | + | #include "UseTheForce/DarkSide/switcheroo_interface.h" | 
| 55 |  | namespace oopse { | 
| 56 |  |  | 
| 57 |  | ForceField::ForceField() { | 
| 69 |  |  | 
| 70 |  | ForceField::~ForceField() { | 
| 71 |  | deleteAtypes(); | 
| 72 | + | deleteSwitch(); | 
| 73 |  | } | 
| 74 |  |  | 
| 75 |  | AtomType* ForceField::getAtomType(const std::string &at) { | 
| 255 |  |  | 
| 256 |  | } | 
| 257 |  |  | 
| 258 | + | void ForceField::setFortranForceOptions(){ | 
| 259 | + | ForceOptions theseFortranOptions; | 
| 260 | + | forceFieldOptions_.makeFortranOptions(theseFortranOptions); | 
| 261 | + | setfForceOptions(&theseFortranOptions); | 
| 262 | + | } | 
| 263 |  | } //end namespace oopse |