Action_Thermostats
Adding_Graph_to_ChangeBondActions
Adding_MD_integration_tests
Adding_StructOpt_integration_tests
AutomationFragmentation_failures
Candidate_v1.6.1
ChemicalSpaceEvaluator
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Example_ManyWaysToTranslateAtom
Exclude_Hydrogens_annealWithBondGraph
Fix_Verbose_Codepatterns
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_continued
ForceAnnealing_with_BondGraph_continued_betteresults
ForceAnnealing_with_BondGraph_contraction-expansion
Gui_displays_atomic_force_velocity
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
PythonUI_with_named_parameters
Recreated_GuiChecks
StoppableMakroAction
TremoloParser_IncreasedPrecision
TremoloParser_MultipleTimesteps
Last change
on this file since 70f2a1 was aa91de0, checked in by Frederik Heber <frederik.heber@…>, 8 years ago |
FIX: size_t definition missing and other fixes.
- cstddef defines both size_t and NULL.
- also string include missing.
- this is in preparation for removing MemDebug include.
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Property mode
set to
100644
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File size:
1.7 KB
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1 | /*
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2 | * BaseFillerPrepator.hpp
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3 | *
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4 | * Created on: Sep 2, 2014
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5 | * Author: heber
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6 | */
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7 |
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8 | #ifndef BASEFILLERPREPARATOR_HPP_
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9 | #define BASEFILLERPREPARATOR_HPP_
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10 |
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11 | // include config.h
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12 | #ifdef HAVE_CONFIG_H
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13 | #include <config.h>
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14 | #endif
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15 |
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16 | #include <cstddef>
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17 |
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18 | class atom;
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19 | class Filler;
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20 | class FillPredicate;
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21 | class Inserter;
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22 | class LinkedCell_deprecated;
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23 | class Mesh;
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24 | class molecule;
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25 | class Tesselation;
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26 |
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27 | #include <vector>
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28 |
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29 | /** BaseFillerPrepator is the base class for all specific filler preparators.
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30 | *
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31 | * Specific preparators combine all the various aspects of filling into a specific
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32 | * package for easy and convenient calling for returning a filler function.
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33 | *
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34 | * It defines both the interface and implements some common functions.
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35 | */
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36 | class BaseFillerPreparator
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37 | {
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38 | public:
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39 | BaseFillerPreparator(molecule *_filler);
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40 | virtual ~BaseFillerPreparator();
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41 |
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42 | void addSurfacePredicate(
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43 | const double _radius,
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44 | std::vector<atom *> &_atoms,
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45 | const double minimum_distance = 0.);
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46 | void addRandomInserter(
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47 | const double _RandAtomDisplacement,
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48 | const double _RandMoleculeDisplacement,
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49 | const bool _DoRotate);
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50 | void addVoidPredicate(
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51 | const double _mindistance);
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52 | bool operator()();
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53 |
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54 | /* The operator is just a getter for the constructed fillerFunction.
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55 | *
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56 | * \return allocated Filler (is not deleted here)
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57 | */
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58 | Filler* obtainFiller()
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59 | {
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60 | Filler *temp = fillerFunction;
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61 | fillerFunction = NULL;
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62 | return temp;
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63 | }
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64 |
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65 | protected:
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66 | molecule *filler;
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67 | FillPredicate * surface_predicate;
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68 | LinkedCell_deprecated * LC;
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69 | Tesselation * TesselStruct;
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70 | FillPredicate *voidnode_predicate;
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71 | FillPredicate *Andpredicate;
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72 | Mesh *mesh;
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73 | Inserter *inserter;
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74 | Filler *fillerFunction;
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75 | };
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76 |
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77 |
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78 | #endif /* BASEFILLERPREPARATOR_HPP_ */
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