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faunus
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Public Member Functions | |
| SystemProperty (const json &j, const Space &spc) | |
| void | _to_json (json &j) const override |
| json serialization | |
Public Member Functions inherited from Faunus::ReactionCoordinate::ReactionCoordinateBase | |
| ReactionCoordinateBase (const json &j) | |
| constructor reads resolution, min, max | |
| double | operator() () |
| Calculates reaction coordinate. | |
| bool | inRange (double coord) const |
| Determines if coordinate is within [min,max]. | |
Protected Attributes | |
| std::string | property |
Protected Attributes inherited from Faunus::ReactionCoordinate::ReactionCoordinateBase | |
| std::function< double()> | function = nullptr |
| returns reaction coordinate Default 1.0; currently unused | |
Additional Inherited Members | |
Public Attributes inherited from Faunus::ReactionCoordinate::ReactionCoordinateBase | |
| double | resolution = 0.0 |
| Resolution used when binning (histograms etc.) | |
| double | minimum_value = 0.0 |
| Minimum allowed value. | |
| double | maximum_value = 0.0 |
| Maximum allowed value. | |
| std::string | name |
| Meaningful, short name. Don't use spaces or weird characters. | |
1.8.13