| [bcf653] | 1 | /*
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 | 2 |  * Project: MoleCuilder
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 | 3 |  * Description: creates and alters molecular systems
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 | 4 |  * Copyright (C)  2010 University of Bonn. All rights reserved.
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 | 5 |  * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
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 | 6 |  */
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 | 7 | 
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| [97ebf8] | 8 | /*
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 | 9 |  * NonConvexEnvelopeAction.cpp
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 | 10 |  *
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 | 11 |  *  Created on: May 10, 2010
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 | 12 |  *      Author: heber
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 | 13 |  */
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 | 14 | 
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| [bf3817] | 15 | // include config.h
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 | 16 | #ifdef HAVE_CONFIG_H
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 | 17 | #include <config.h>
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 | 18 | #endif
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 | 19 | 
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| [112b09] | 20 | #include "Helpers/MemDebug.hpp"
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 | 21 | 
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| [97ebf8] | 22 | #include "Actions/TesselationAction/NonConvexEnvelopeAction.hpp"
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| [0430e3] | 23 | #include "Actions/ActionRegistry.hpp"
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| [628b52] | 24 | #include "boundary.hpp"
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 | 25 | #include "linkedcell.hpp"
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| [952f38] | 26 | #include "Helpers/Log.hpp"
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| [628b52] | 27 | #include "molecule.hpp"
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| [88b400] | 28 | #include "tesselation.hpp"
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| [952f38] | 29 | #include "Helpers/Verbose.hpp"
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| [628b52] | 30 | #include "World.hpp"
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| [97ebf8] | 31 | 
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 | 32 | #include <iostream>
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 | 33 | #include <string>
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 | 34 | 
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 | 35 | using namespace std;
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 | 36 | 
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 | 37 | #include "UIElements/UIFactory.hpp"
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 | 38 | #include "UIElements/Dialog.hpp"
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| [861874] | 39 | #include "Actions/ValueStorage.hpp"
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| [97ebf8] | 40 | 
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 | 41 | /****** TesselationNonConvexEnvelopeAction *****/
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 | 42 | 
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 | 43 | // memento to remember the state when undoing
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 | 44 | 
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 | 45 | //class TesselationNonConvexEnvelopeState : public ActionState {
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 | 46 | //public:
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 | 47 | //  TesselationNonConvexEnvelopeState(molecule* _mol,std::string _lastName) :
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 | 48 | //    mol(_mol),
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 | 49 | //    lastName(_lastName)
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 | 50 | //  {}
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 | 51 | //  molecule* mol;
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 | 52 | //  std::string lastName;
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 | 53 | //};
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 | 54 | 
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 | 55 | const char TesselationNonConvexEnvelopeAction::NAME[] = "nonconvex-envelope";
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 | 56 | 
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 | 57 | TesselationNonConvexEnvelopeAction::TesselationNonConvexEnvelopeAction() :
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 | 58 |   Action(NAME)
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 | 59 | {}
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 | 60 | 
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 | 61 | TesselationNonConvexEnvelopeAction::~TesselationNonConvexEnvelopeAction()
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 | 62 | {}
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 | 63 | 
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| [628b52] | 64 | void TesselationNonConvexEnvelope(double radius, std::string &filename) {
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 | 65 |   ValueStorage::getInstance().setCurrentValue(TesselationNonConvexEnvelopeAction::NAME, radius);
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 | 66 |   ValueStorage::getInstance().setCurrentValue("nonconvex-file", filename);
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 | 67 |   ActionRegistry::getInstance().getActionByName(TesselationNonConvexEnvelopeAction::NAME)->call(Action::NonInteractive);
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 | 68 | };
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 | 69 | 
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| [047878] | 70 | Dialog* TesselationNonConvexEnvelopeAction::fillDialog(Dialog *dialog) {
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 | 71 |   ASSERT(dialog,"No Dialog given when filling action dialog");
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| [ff4fd2a] | 72 | 
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| [c89fb4] | 73 |   dialog->queryDouble(NAME, ValueStorage::getInstance().getDescription(NAME));
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 | 74 |   dialog->queryString("nonconvex-file", ValueStorage::getInstance().getDescription("nonconvex-file"));
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| [ff4fd2a] | 75 | 
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 | 76 |   return dialog;
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 | 77 | }
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 | 78 | 
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| [97ebf8] | 79 | Action::state_ptr TesselationNonConvexEnvelopeAction::performCall() {
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 | 80 |   string filename;
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 | 81 |   molecule * Boundary = NULL;
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 | 82 |   double SphereRadius = 0;
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 | 83 |   bool Success = false;
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 | 84 |   clock_t start,end;
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 | 85 | 
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| [1d9b7d2] | 86 |   ValueStorage::getInstance().queryCurrentValue(NAME, SphereRadius);
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| [ff4fd2a] | 87 |   ValueStorage::getInstance().queryCurrentValue("nonconvex-file", filename);
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| [97ebf8] | 88 | 
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| [ff4fd2a] | 89 |   for (World::MoleculeSelectionIterator iter = World::getInstance().beginMoleculeSelection(); iter != World::getInstance().endMoleculeSelection(); ++iter) {
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 | 90 |     Boundary = iter->second;
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| [97ebf8] | 91 |     class Tesselation *T = NULL;
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 | 92 |     const LinkedCell *LCList = NULL;
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 | 93 |     DoLog(0) && (Log() << Verbose(0) << "Evaluating non-convex envelope of molecule." << Boundary->getId() << endl);
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 | 94 |     DoLog(1) && (Log() << Verbose(1) << "Using rolling ball of radius " << SphereRadius << " and storing tecplot data in " << filename << "." << endl);
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| [1024cb] | 95 |     DoLog(1) && (Log() << Verbose(1) << "Specified molecule has " << Boundary->getAtomCount() << " atoms." << endl);
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| [97ebf8] | 96 |     start = clock();
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 | 97 |     LCList = new LinkedCell(Boundary, SphereRadius*2.);
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 | 98 |     Success = FindNonConvexBorder(Boundary, T, LCList, SphereRadius, filename.c_str());
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 | 99 |     //FindDistributionOfEllipsoids(T, &LCList, N, number, filename.c_str());
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 | 100 |     end = clock();
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 | 101 |     DoLog(0) && (Log() << Verbose(0) << "Clocks for this operation: " << (end-start) << ", time: " << ((double)(end-start)/CLOCKS_PER_SEC) << "s." << endl);
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 | 102 |     delete(LCList);
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 | 103 |     delete(T);
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 | 104 |   }
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| [ff4fd2a] | 105 |   if (Success)
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 | 106 |     return Action::success;
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 | 107 |   else
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 | 108 |     return Action::failure;
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| [97ebf8] | 109 | }
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 | 110 | 
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 | 111 | Action::state_ptr TesselationNonConvexEnvelopeAction::performUndo(Action::state_ptr _state) {
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 | 112 | //  TesselationNonConvexEnvelopeState *state = assert_cast<TesselationNonConvexEnvelopeState*>(_state.get());
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 | 113 | 
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 | 114 | //  string newName = state->mol->getName();
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 | 115 | //  state->mol->setName(state->lastName);
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 | 116 | 
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 | 117 |   return Action::failure;
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 | 118 | }
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 | 119 | 
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 | 120 | Action::state_ptr TesselationNonConvexEnvelopeAction::performRedo(Action::state_ptr _state){
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 | 121 |   // Undo and redo have to do the same for this action
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 | 122 |   return performUndo(_state);
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 | 123 | }
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 | 124 | 
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 | 125 | bool TesselationNonConvexEnvelopeAction::canUndo() {
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 | 126 |   return false;
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 | 127 | }
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 | 128 | 
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 | 129 | bool TesselationNonConvexEnvelopeAction::shouldUndo() {
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 | 130 |   return false;
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 | 131 | }
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 | 132 | 
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 | 133 | const string TesselationNonConvexEnvelopeAction::getName() {
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 | 134 |   return NAME;
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 | 135 | }
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