| 51 | 
  | 
#include "UseTheForce/ForceField.hpp" | 
| 52 | 
  | 
#include "utils/simError.h" | 
| 53 | 
  | 
#include "utils/Tuple.hpp" | 
| 54 | 
– | 
#include "UseTheForce/DarkSide/atype_interface.h" | 
| 55 | 
– | 
#include "UseTheForce/DarkSide/fForceOptions_interface.h" | 
| 56 | 
– | 
#include "UseTheForce/DarkSide/switcheroo_interface.h" | 
| 54 | 
  | 
namespace OpenMD { | 
| 55 | 
  | 
 | 
| 56 | 
  | 
  ForceField::ForceField() {  | 
| 64 | 
  | 
    } else { | 
| 65 | 
  | 
      ffPath_ = tempPath; | 
| 66 | 
  | 
    } | 
| 70 | 
– | 
  } | 
| 71 | 
– | 
 | 
| 72 | 
– | 
 | 
| 73 | 
– | 
  ForceField::~ForceField() { | 
| 74 | 
– | 
    deleteAtypes(); | 
| 75 | 
– | 
    deleteSwitch();    | 
| 67 | 
  | 
  } | 
| 68 | 
  | 
 | 
| 69 | 
  | 
  AtomType* ForceField::getAtomType(const std::string &at) { | 
| 622 | 
  | 
    return ffStream; | 
| 623 | 
  | 
  } | 
| 624 | 
  | 
 | 
| 634 | 
– | 
  void ForceField::setFortranForceOptions(){ | 
| 635 | 
– | 
    ForceOptions theseFortranOptions; | 
| 636 | 
– | 
    forceFieldOptions_.makeFortranOptions(theseFortranOptions); | 
| 637 | 
– | 
    setfForceOptions(&theseFortranOptions); | 
| 638 | 
– | 
  } | 
| 625 | 
  | 
} //end namespace OpenMD |