| 64 |
|
#include "applications/dynamicProps/SystemDipoleCorrFunc.hpp" |
| 65 |
|
#include "applications/dynamicProps/MomentumCorrFunc.hpp" |
| 66 |
|
#include "applications/dynamicProps/cOHz.hpp" |
| 67 |
+ |
#include "applications/dynamicProps/BondCorrFunc.hpp" |
| 68 |
|
|
| 69 |
|
using namespace OpenMD; |
| 70 |
|
|
| 143 |
|
corrFunc = new DirectionalRCorrFunc(info, dumpFileName, sele1, sele2, memSize); |
| 144 |
|
} else if (args_info.vcorr_given) { |
| 145 |
|
corrFunc = new VCorrFunc(info, dumpFileName, sele1, sele2, memSize); |
| 146 |
+ |
} else if (args_info.bondcorr_given) { |
| 147 |
+ |
corrFunc = new BondCorrFunc(info, dumpFileName, sele1, memSize); |
| 148 |
|
} else if (args_info.helfandEcorr_given){ |
| 149 |
|
corrFunc = new EnergyCorrFunc(info, dumpFileName, sele1, sele2, memSize); |
| 150 |
|
} else if (args_info.stresscorr_given){ |