| # | Line 52 | Line 52 | |
|---|---|---|
| 52 | ||
| 53 | #include "brains/SimInfo.hpp" | |
| 54 | #include "primitives/Molecule.hpp" | |
| 55 | < | #include "nonbonded/LJ.hpp" |
| 56 | < | #include "nonbonded/GB.hpp" |
| 57 | < | #include "nonbonded/EAM.hpp" |
| 55 | > | #include "nonbonded/InteractionManager.hpp" |
| 56 | ||
| 57 | namespace OpenMD { | |
| 58 | /** | |
| # | Line 94 | Line 92 | namespace OpenMD { | |
| 92 | Mat3x3d tau; | |
| 93 | ||
| 94 | bool NBforcesInitialized_; | |
| 95 | < | LJ* lj_; |
| 98 | < | GB* gb_; |
| 99 | < | EAM* eam_; |
| 95 | > | InteractionManager* nbiMan_; |
| 96 | ||
| 97 | }; | |
| 98 | ||
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