| 52 |
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| 53 |
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#include "brains/SimInfo.hpp" |
| 54 |
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#include "primitives/Molecule.hpp" |
| 55 |
< |
#include "nonbonded/LJ.hpp" |
| 56 |
< |
#include "nonbonded/GB.hpp" |
| 57 |
< |
#include "nonbonded/Sticky.hpp" |
| 58 |
< |
#include "nonbonded/EAM.hpp" |
| 59 |
< |
#include "nonbonded/SC.hpp" |
| 60 |
< |
#include "nonbonded/Morse.hpp" |
| 61 |
< |
#include "nonbonded/Electrostatic.hpp" |
| 55 |
> |
#include "nonbonded/InteractionManager.hpp" |
| 56 |
> |
#include "parallel/Decomposition.hpp" |
| 57 |
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|
| 58 |
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namespace OpenMD { |
| 59 |
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/** |
| 93 |
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Mat3x3d tau; |
| 94 |
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|
| 95 |
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bool NBforcesInitialized_; |
| 96 |
< |
LJ* lj_; |
| 97 |
< |
GB* gb_; |
| 103 |
< |
Sticky* sticky_; |
| 104 |
< |
EAM* eam_; |
| 105 |
< |
SC* sc_; |
| 106 |
< |
Morse* morse_; |
| 107 |
< |
Electrostatic* electrostatic_; |
| 96 |
> |
InteractionManager* nbiMan_; |
| 97 |
> |
Decomposition* decomp_; |
| 98 |
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|
| 99 |
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}; |
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|
