| [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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| [51769f] | 8 | /*
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| 9 | * NotMoleculeByFormulaAction.cpp
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| 10 | *
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| 11 | * Created on: May 12, 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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| [ad011c] | 20 | #include "CodePatterns/MemDebug.hpp"
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| [51769f] | 21 |
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| 22 | #include "Descriptors/MoleculeFormulaDescriptor.hpp"
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| [ff237c] | 23 | #include "Descriptors/MoleculeSelectionDescriptor.hpp"
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| [51769f] | 24 | #include "molecule.hpp"
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| [ad011c] | 25 | #include "CodePatterns/Log.hpp"
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| 26 | #include "CodePatterns/Verbose.hpp"
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| [51769f] | 27 | #include "World.hpp"
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| 28 |
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| [92d756] | 29 | #include <boost/foreach.hpp>
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| [51769f] | 30 | #include <iostream>
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| 31 | #include <string>
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| 32 |
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| 33 | using namespace std;
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| 34 |
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| [125002] | 35 | #include "NotMoleculeByFormulaAction.hpp"
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| [51769f] | 36 |
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| [1fd675] | 37 | // and construct the stuff
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| 38 | #include "NotMoleculeByFormulaAction.def"
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| 39 | #include "Action_impl_pre.hpp"
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| 40 | /** =========== define the function ====================== */
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| [51769f] | 41 | Action::state_ptr SelectionNotMoleculeByFormulaAction::performCall() {
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| [1fd675] | 42 | // obtain information
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| 43 | getParametersfromValueStorage();
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| [51769f] | 44 |
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| [b7fbf0] | 45 | // check whether molecules are present at all
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| 46 | if (World::getInstance().numMolecules() == 0) {
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| 47 | ELOG(1, "No molecules present in the world to select!");
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| 48 | return Action::failure;
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| 49 | }
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| 50 |
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| [1fd675] | 51 | DoLog(1) && (Log() << Verbose(1) << "Unselecting molecules with chemical formula " << params.formula << ":" << endl);
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| 52 | std::vector<molecule *> matchingMolecules = World::getInstance().getAllMolecules(MoleculeByFormula(params.formula));
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| [ff237c] | 53 | std::vector<molecule *> unselectedMolecules = World::getInstance().getAllMolecules(!MoleculesBySelection());
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| [1fd675] | 54 | World::getInstance().unselectAllMolecules(MoleculeByFormula(params.formula));
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| [aa4b2d] | 55 | DoLog(0) && (Log() << Verbose(0) << World::getInstance().countSelectedMolecules() << " molecules remain selected." << endl);
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| [92d756] | 56 | return Action::state_ptr(new SelectionNotMoleculeByFormulaState(unselectedMolecules,params));
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| [51769f] | 57 | }
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| 58 |
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| 59 | Action::state_ptr SelectionNotMoleculeByFormulaAction::performUndo(Action::state_ptr _state) {
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| 60 | SelectionNotMoleculeByFormulaState *state = assert_cast<SelectionNotMoleculeByFormulaState*>(_state.get());
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| 61 |
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| [92d756] | 62 | World::getInstance().selectAllMolecules(MoleculeByFormula(state->params.formula));
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| 63 | BOOST_FOREACH( molecule *mol, state->unselectedMolecules)
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| 64 | World::getInstance().unselectMolecule(mol);
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| [51769f] | 65 |
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| 66 | return Action::state_ptr(_state);
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| 67 | }
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| 68 |
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| 69 | Action::state_ptr SelectionNotMoleculeByFormulaAction::performRedo(Action::state_ptr _state){
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| 70 | SelectionNotMoleculeByFormulaState *state = assert_cast<SelectionNotMoleculeByFormulaState*>(_state.get());
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| 71 |
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| [1fd675] | 72 | World::getInstance().unselectAllMolecules(MoleculeByFormula(state->params.formula));
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| [51769f] | 73 |
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| 74 | return Action::state_ptr(_state);
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| 75 | }
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| 76 |
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| 77 | bool SelectionNotMoleculeByFormulaAction::canUndo() {
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| 78 | return true;
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| 79 | }
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| 80 |
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| 81 | bool SelectionNotMoleculeByFormulaAction::shouldUndo() {
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| 82 | return true;
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| 83 | }
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| [1fd675] | 84 | /** =========== end of function ====================== */
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