| 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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| 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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| 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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| 20 | #include "CodePatterns/MemDebug.hpp"
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| 21 | 
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| 22 | #include "Tesselation/boundary.hpp"
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| 23 | #include "CodePatterns/Log.hpp"
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| 24 | #include "CodePatterns/Verbose.hpp"
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| 25 | #include "linkedcell.hpp"
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| 26 | #include "molecule.hpp"
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| 27 | #include "PointCloudAdaptor.hpp"
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| 28 | #include "Tesselation/tesselation.hpp"
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| 29 | #include "World.hpp"
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| 30 | 
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| 31 | #include <iostream>
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| 32 | #include <string>
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| 33 | 
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| 34 | #include "Actions/TesselationAction/NonConvexEnvelopeAction.hpp"
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| 35 | 
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| 36 | using namespace MoleCuilder;
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| 37 | 
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| 38 | // and construct the stuff
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| 39 | #include "NonConvexEnvelopeAction.def"
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| 40 | #include "Action_impl_pre.hpp"
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| 41 | /** =========== define the function ====================== */
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| 42 | Action::state_ptr TesselationNonConvexEnvelopeAction::performCall() {
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| 43 |   molecule * Boundary = NULL;
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| 44 |   bool Success = false;
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| 45 |   clock_t start,end;
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| 46 | 
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| 47 |   // obtain information
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| 48 |   getParametersfromValueStorage();
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| 49 | 
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| 50 |   for (World::MoleculeSelectionIterator iter = World::getInstance().beginMoleculeSelection(); iter != World::getInstance().endMoleculeSelection(); ++iter) {
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| 51 |     Boundary = iter->second;
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| 52 |     class Tesselation *T = NULL;
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| 53 |     const LinkedCell *LCList = NULL;
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| 54 |     DoLog(0) && (Log() << Verbose(0) << "Evaluating non-convex envelope of molecule." << Boundary->getId() << endl);
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| 55 |     DoLog(1) && (Log() << Verbose(1) << "Using rolling ball of radius " << params.SphereRadius << " and storing tecplot data in " << params.filename << "." << endl);
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| 56 |     DoLog(1) && (Log() << Verbose(1) << "Specified molecule has " << Boundary->getAtomCount() << " atoms." << endl);
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| 57 |     start = clock();
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| 58 |     PointCloudAdaptor< molecule > cloud(Boundary, Boundary->name);
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| 59 |     LCList = new LinkedCell(cloud, params.SphereRadius*2.);
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| 60 |     Success = FindNonConvexBorder(Boundary, T, LCList, params.SphereRadius, params.filename.string().c_str());
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| 61 |     //FindDistributionOfEllipsoids(T, &LCList, N, number, params.filename.c_str());
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| 62 |     end = clock();
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| 63 |     DoLog(0) && (Log() << Verbose(0) << "Clocks for this operation: " << (end-start) << ", time: " << ((double)(end-start)/CLOCKS_PER_SEC) << "s." << endl);
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| 64 |     delete(LCList);
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| 65 |     delete(T);
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| 66 |   }
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| 67 |   if (Success)
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| 68 |     return Action::success;
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| 69 |   else
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| 70 |     return Action::failure;
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| 71 | }
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| 72 | 
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| 73 | Action::state_ptr TesselationNonConvexEnvelopeAction::performUndo(Action::state_ptr _state) {
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| 74 | //  TesselationNonConvexEnvelopeState *state = assert_cast<TesselationNonConvexEnvelopeState*>(_state.get());
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| 75 | 
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| 76 | //  string newName = state->mol->getName();
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| 77 | //  state->mol->setName(state->lastName);
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| 78 | 
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| 79 |   return Action::failure;
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| 80 | }
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| 81 | 
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| 82 | Action::state_ptr TesselationNonConvexEnvelopeAction::performRedo(Action::state_ptr _state){
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| 83 |   // Undo and redo have to do the same for this action
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| 84 |   return performUndo(_state);
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| 85 | }
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| 86 | 
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| 87 | bool TesselationNonConvexEnvelopeAction::canUndo() {
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| 88 |   return false;
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| 89 | }
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| 90 | 
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| 91 | bool TesselationNonConvexEnvelopeAction::shouldUndo() {
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| 92 |   return false;
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| 93 | }
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| 94 | /** =========== end of function ====================== */
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