| [97ebf8] | 1 | /* | 
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|  | 2 | * SubgraphDissectionAction.cpp | 
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|  | 3 | * | 
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|  | 4 | *  Created on: May 9, 2010 | 
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|  | 5 | *      Author: heber | 
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|  | 6 | */ | 
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|  | 7 |  | 
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| [112b09] | 8 | #include "Helpers/MemDebug.hpp" | 
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|  | 9 |  | 
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| [97ebf8] | 10 | #include "Actions/FragmentationAction/SubgraphDissectionAction.hpp" | 
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|  | 11 | #include "atom.hpp" | 
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|  | 12 | #include "config.hpp" | 
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|  | 13 | #include "log.hpp" | 
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|  | 14 | #include "molecule.hpp" | 
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|  | 15 | #include "Descriptors/MoleculeDescriptor.hpp" | 
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|  | 16 | #include "stackclass.hpp" | 
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|  | 17 | #include "World.hpp" | 
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|  | 18 |  | 
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|  | 19 | #include <iostream> | 
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|  | 20 | #include <string> | 
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|  | 21 |  | 
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|  | 22 | using namespace std; | 
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|  | 23 |  | 
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|  | 24 | #include "UIElements/UIFactory.hpp" | 
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|  | 25 | #include "UIElements/Dialog.hpp" | 
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|  | 26 | #include "Actions/MapOfActions.hpp" | 
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|  | 27 |  | 
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| [6866aa] | 28 | const char FragmentationSubgraphDissectionAction::NAME[] = "subgraph-dissect"; | 
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| [97ebf8] | 29 |  | 
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|  | 30 | FragmentationSubgraphDissectionAction::FragmentationSubgraphDissectionAction() : | 
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|  | 31 | Action(NAME) | 
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|  | 32 | {} | 
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|  | 33 |  | 
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|  | 34 | FragmentationSubgraphDissectionAction::~FragmentationSubgraphDissectionAction() | 
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|  | 35 | {} | 
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|  | 36 |  | 
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|  | 37 | Action::state_ptr FragmentationSubgraphDissectionAction::performCall() { | 
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|  | 38 | Dialog *dialog = UIFactory::getInstance().makeDialog(); | 
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|  | 39 |  | 
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|  | 40 | dialog->queryEmpty(NAME, MapOfActions::getInstance().getDescription(NAME)); | 
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|  | 41 |  | 
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|  | 42 | if(dialog->display()) { | 
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| [6866aa] | 43 | DoLog(1) && (Log() << Verbose(1) << "Dissecting molecular system into a set of disconnected subgraphs ... " << endl); | 
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|  | 44 | // @TODO rather do the dissection afterwards | 
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|  | 45 | MoleculeListClass *molecules = World::getInstance().getMolecules(); | 
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|  | 46 | molecules->DissectMoleculeIntoConnectedSubgraphs(World::getInstance().getPeriode(), World::getInstance().getConfig()); | 
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| [97ebf8] | 47 | delete dialog; | 
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|  | 48 | return Action::success; | 
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|  | 49 | } else { | 
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|  | 50 | delete dialog; | 
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|  | 51 | return Action::failure; | 
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|  | 52 | } | 
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|  | 53 | } | 
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|  | 54 |  | 
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|  | 55 | Action::state_ptr FragmentationSubgraphDissectionAction::performUndo(Action::state_ptr _state) { | 
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|  | 56 | //  ParserLoadXyzState *state = assert_cast<ParserLoadXyzState*>(_state.get()); | 
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|  | 57 |  | 
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|  | 58 | return Action::failure; | 
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|  | 59 | //  string newName = state->mol->getName(); | 
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|  | 60 | //  state->mol->setName(state->lastName); | 
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|  | 61 | // | 
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|  | 62 | //  return Action::state_ptr(new ParserLoadXyzState(state->mol,newName)); | 
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|  | 63 | } | 
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|  | 64 |  | 
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|  | 65 | Action::state_ptr FragmentationSubgraphDissectionAction::performRedo(Action::state_ptr _state){ | 
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|  | 66 | return Action::failure; | 
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|  | 67 | } | 
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|  | 68 |  | 
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|  | 69 | bool FragmentationSubgraphDissectionAction::canUndo() { | 
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|  | 70 | return false; | 
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|  | 71 | } | 
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|  | 72 |  | 
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|  | 73 | bool FragmentationSubgraphDissectionAction::shouldUndo() { | 
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|  | 74 | return false; | 
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|  | 75 | } | 
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|  | 76 |  | 
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|  | 77 | const string FragmentationSubgraphDissectionAction::getName() { | 
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|  | 78 | return NAME; | 
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|  | 79 | } | 
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