Candidate_v1.7.0
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| 1 | /* | 
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| 2 | * SurfaceRandomInserter.hpp | 
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| 3 | * | 
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| 4 | *  Created on: Apr 03, 2012 | 
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| 5 | *      Author: heber | 
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| 6 | */ | 
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| 7 |  | 
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| 8 | #ifndef SURFACERANDOMINSERTER_HPP_ | 
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| 9 | #define SURFACERANDOMINSERTER_HPP_ | 
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| 10 |  | 
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| 11 |  | 
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| 12 | // include config.h | 
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| 13 | #ifdef HAVE_CONFIG_H | 
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| 14 | #include <config.h> | 
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| 15 | #endif | 
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| 16 |  | 
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| 17 | #include "Filling/Inserter/RandomInserter.hpp" | 
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| 18 |  | 
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| 19 | #include "LinearAlgebra/Vector.hpp" | 
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| 20 | #include "Shapes/Shape.hpp" | 
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| 21 |  | 
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| 22 | /** SurfaceRandomInserter extends RandomInserter such that the given \a Cluster | 
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| 23 | * is inserted at the given position in such a way as to be aligned perpendicularly | 
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| 24 | * away from the surface (but with the usual random displacements) | 
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| 25 | * | 
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| 26 | * \note We assume that cluster is aligned along the Z axis. | 
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| 27 | * | 
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| 28 | */ | 
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| 29 | class SurfaceRandomInserter : public RandomInserter | 
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| 30 | { | 
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| 31 | public: | 
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| 32 | SurfaceRandomInserter( | 
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| 33 | const Shape & _s, | 
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| 34 | const Vector &_alignedAxis, | 
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| 35 | const double _MaxAtomComponent, | 
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| 36 | const double _MaxMoleculeComponent); | 
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| 37 | ~SurfaceRandomInserter(); | 
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| 38 |  | 
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| 39 | bool operator()(ClusterInterface::Cluster_impl cluster, const Vector &offset) const; | 
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| 40 |  | 
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| 41 | private: | 
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| 42 | const Shape shape; | 
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| 43 | const Vector alignedAxis; | 
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| 44 | }; | 
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| 45 |  | 
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| 46 |  | 
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| 47 |  | 
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| 48 | #endif /* SURFACERANDOMINSERTER_HPP_ */ | 
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