| 1 | /* | 
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| 2 | * FillRegularGridAction.def | 
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| 3 | * | 
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| 4 | *  Created on: Jan 20, 2012 | 
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| 5 | *      Author: heber | 
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| 6 | */ | 
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| 7 |  | 
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| 8 | // all includes and forward declarations necessary for non-integral types below | 
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| 9 | #include <vector> | 
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| 10 | #include "Atom/AtomicInfo.hpp" | 
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| 11 | #include "Bond/BondInfo.hpp" | 
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| 12 | #include "types.hpp" | 
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| 13 |  | 
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| 14 | // i.e. there is an integer with variable name Z that can be found in | 
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| 15 | // ValueStorage by the token "Z" -> first column: int, Z, "Z" | 
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| 16 | // "undefine" if no parameters are required, use (NODEFAULT) for each (undefined) default value | 
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| 17 | #define paramtypes (Vector)(Vector)(double)(double)(double)(double)(bool) | 
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| 18 | #define paramtokens ("mesh-size")("mesh-offset")("min-distance")("tesselation-radius")("random-atom-displacement")("random-molecule-displacement")("DoRotate") | 
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| 19 | #define paramdescriptions ("number of points per axis")("offset to start of partition, must be in [0,1)")("Minimum distance to other atoms")("radius of rolling sphere in tesselating selected molecule's surfaces")("magnitude of random atom displacement")("magnitude of random molecule displacement")("whether to rotate or not") | 
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| 20 | #define paramdefaults (NODEFAULT)("0.,0.,0.")("1.")("0.")("0.")("0.")("0") | 
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| 21 | #define paramreferences (counts)(offset)(mindistance)(SphereRadius)(RandAtomDisplacement)(RandMoleculeDisplacement)(DoRotate) | 
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| 22 |  | 
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| 23 | #define statetypes (std::vector<AtomicInfo>)(std::vector<BondInfo>)(std::vector<AtomicInfo>)(std::vector<Vector>) | 
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| 24 | #define statereferences (clonedatoms)(clonedbonds)(movedatoms)(MovedToVector) | 
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| 25 |  | 
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| 26 | // some defines for all the names, you may use ACTION, STATE and PARAMS | 
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| 27 | #define CATEGORY Fill | 
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| 28 | #define MENUNAME "fill" | 
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| 29 | #define MENUPOSITION 1 | 
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| 30 | #define ACTIONNAME RegularGrid | 
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| 31 | #define TOKEN "fill-regular-grid" | 
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| 32 |  | 
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| 33 |  | 
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| 34 | // finally the information stored in the ActionTrait specialization | 
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| 35 | #define DESCRIPTION "\ | 
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| 36 | fill the domain via a regularly sparsed grid of insertion points with the \ | 
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| 37 | currently selected molecule. If atoms are selected, too, they are surrounded by \ | 
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| 38 | a tesselated surface and only outside of the tesselation is filled." | 
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| 39 | #undef SHORTFORM | 
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