140 |
|
DeclareParameter(RNEMD_exchangeType, std::string); |
141 |
|
DeclareParameter(RNEMD_objectSelection, std::string); |
142 |
|
DeclareParameter(RNEMD_targetFlux, RealType); |
143 |
+ |
DeclareParameter(RNEMD_targetJzKE, RealType); |
144 |
+ |
DeclareParameter(RNEMD_targetJzpx, RealType); |
145 |
+ |
DeclareParameter(RNEMD_targetJzpy, RealType); |
146 |
+ |
DeclareParameter(RNEMD_targetJzpz, RealType); |
147 |
|
DeclareParameter(RNEMD_binShift, bool); |
148 |
< |
DeclareParameter(RNEMD_outputDimensionalTemperature, bool); |
148 |
> |
DeclareParameter(RNEMD_outputTemperature, bool); |
149 |
> |
DeclareParameter(RNEMD_outputVx, bool); |
150 |
> |
DeclareParameter(RNEMD_outputVy, bool); |
151 |
> |
DeclareParameter(RNEMD_outputXyzTemperature, bool); |
152 |
> |
DeclareParameter(RNEMD_outputRotTemperature, bool); |
153 |
|
DeclareParameter(UseRestraints, bool); |
154 |
|
DeclareParameter(Restraint_file, std::string); |
155 |
|
DeclareParameter(HULL_Method, std::string); |