| [a88452] | 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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| [80ca29] | 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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| [a88452] | 13 |  | 
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| [23958d] | 14 | #include "LinearAlgebra/defs.hpp" | 
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| [649aaa] | 15 | #include "Parameters/Validators/DummyValidator.hpp" | 
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| [23958d] | 16 | #include "Parameters/Validators/STLVectorValidator.hpp" | 
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|  | 17 | #include "Parameters/Validators/Specific/BoxLengthValidator.hpp" | 
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|  | 18 | #include "Parameters/Validators/Specific/VectorZeroOneComponentsValidator.hpp" | 
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| [649aaa] | 19 |  | 
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| [a88452] | 20 | // i.e. there is an integer with variable name Z that can be found in | 
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|  | 21 | // ValueStorage by the token "Z" -> first column: int, Z, "Z" | 
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| [6ba9ba] | 22 | // "undefine" if no parameters are required, use (NOPARAM_DEFAULT) for each (undefined) default value | 
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| [2382d7] | 23 | #define paramtypes (std::vector< unsigned int >)(Vector)(double)(double)(double)(double)(bool) | 
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| [896f4a] | 24 | #define paramtokens ("mesh-size")("mesh-offset")("min-distance")("tesselation-radius")("random-atom-displacement")("random-molecule-displacement")("DoRotate") | 
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|  | 25 | #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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| [6ba9ba] | 26 | #define paramdefaults (NOPARAM_DEFAULT)(PARAM_DEFAULT(Vector(0.,0.,0.)))(PARAM_DEFAULT(1.))(PARAM_DEFAULT(0.))(PARAM_DEFAULT(0.))(PARAM_DEFAULT(0.))(PARAM_DEFAULT(false)) | 
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| [896f4a] | 27 | #define paramreferences (counts)(offset)(mindistance)(SphereRadius)(RandAtomDisplacement)(RandMoleculeDisplacement)(DoRotate) | 
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| [23958d] | 28 | #define paramvalids \ | 
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|  | 29 | (STLVectorValidator< std::vector< unsigned int > >(NDIM, NDIM)) \ | 
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|  | 30 | (VectorZeroOneComponentsValidator()) \ | 
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|  | 31 | (BoxLengthValidator()) \ | 
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|  | 32 | (BoxLengthValidator()) \ | 
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|  | 33 | (BoxLengthValidator()) \ | 
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|  | 34 | (BoxLengthValidator()) \ | 
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|  | 35 | (DummyValidator< bool >()) | 
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| [a88452] | 36 |  | 
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| [80ca29] | 37 | #define statetypes (std::vector<AtomicInfo>)(std::vector<BondInfo>)(std::vector<AtomicInfo>)(std::vector<Vector>) | 
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|  | 38 | #define statereferences (clonedatoms)(clonedbonds)(movedatoms)(MovedToVector) | 
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| [a88452] | 39 |  | 
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|  | 40 | // some defines for all the names, you may use ACTION, STATE and PARAMS | 
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|  | 41 | #define CATEGORY Fill | 
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|  | 42 | #define MENUNAME "fill" | 
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|  | 43 | #define MENUPOSITION 1 | 
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|  | 44 | #define ACTIONNAME RegularGrid | 
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|  | 45 | #define TOKEN "fill-regular-grid" | 
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|  | 46 |  | 
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|  | 47 |  | 
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|  | 48 | // finally the information stored in the ActionTrait specialization | 
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| [e9ad43] | 49 | #define DESCRIPTION "\ | 
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|  | 50 | fill the domain via a regularly sparsed grid of insertion points with the \ | 
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|  | 51 | currently selected molecule. If atoms are selected, too, they are surrounded by \ | 
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|  | 52 | a tesselated surface and only outside of the tesselation is filled." | 
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| [a88452] | 53 | #undef SHORTFORM | 
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