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* University of Notre Dame has been advised of the possibility of |
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* such damages. |
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*/ |
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< |
|
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> |
#define __C |
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#include "io/ForceFieldOptions.hpp" |
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+ |
#include "UseTheForce/fForceOptions.h" |
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+ |
#include "UseTheForce/DarkSide/fForceOptions_interface.h" |
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namespace oopse { |
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|
|
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ForceFieldOptions::ForceFieldOptions() { |
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DefineOptionalParameterWithDefaultValue(dielectric, "dielectric", 1.0); |
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} |
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|
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+ |
|
63 |
+ |
void ForceFieldOptions::tellFortranOptions(){ |
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+ |
ForceOptions fortranForceOptions; |
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+ |
|
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+ |
fortranForceOptions.vdw14scale = this->getvdw14scale(); |
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+ |
fortranForceOptions.vdw14scale = this->getvdw14scale(); |
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+ |
|
69 |
+ |
|
70 |
+ |
} |
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+ |
|
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} |