/* * Project: MoleCuilder * Description: creates and alters molecular systems * Copyright (C) 2010-2012 University of Bonn. All rights reserved. * Please see the LICENSE file or "Copyright notice" in builder.cpp for details. */ /* * MoleculeByFormulaAction.cpp * * Created on: May 12, 2010 * Author: heber */ // include config.h #ifdef HAVE_CONFIG_H #include #endif #include "CodePatterns/MemDebug.hpp" #include "Descriptors/MoleculeFormulaDescriptor.hpp" #include "Descriptors/MoleculeSelectionDescriptor.hpp" #include "molecule.hpp" #include "CodePatterns/Log.hpp" #include "CodePatterns/Verbose.hpp" #include "World.hpp" #include #include #include #include "MoleculeByFormulaAction.hpp" using namespace MoleCuilder; // and construct the stuff #include "MoleculeByFormulaAction.def" #include "Action_impl_pre.hpp" /** =========== define the function ====================== */ Action::state_ptr SelectionMoleculeByFormulaAction::performCall() { LOG(1, "Selecting molecules with chemical formula " << params.formula << ":"); // std::vector matchingMolecules = World::getInstance().getAllMolecules(MoleculeByFormula(params.formula)); std::vector selectedMolecules = World::getInstance().getAllMolecules(MoleculesBySelection() && MoleculeByFormula(params.formula)); // BOOST_FOREACH(molecule *mol, matchingMolecules) // LOG(1, "\t" << mol->getId() << ", " << mol->getName() << "."); World::getInstance().selectAllMolecules(MoleculeByFormula(params.formula)); LOG(0, World::getInstance().countSelectedMolecules() << " molecules selected."); return Action::state_ptr(new SelectionMoleculeByFormulaState(selectedMolecules,params)); } Action::state_ptr SelectionMoleculeByFormulaAction::performUndo(Action::state_ptr _state) { SelectionMoleculeByFormulaState *state = assert_cast(_state.get()); World::getInstance().unselectAllMolecules(MoleculeByFormula(state->params.formula)); BOOST_FOREACH( molecule *mol, state->selectedMolecules) World::getInstance().selectMolecule(mol); return Action::state_ptr(_state); } Action::state_ptr SelectionMoleculeByFormulaAction::performRedo(Action::state_ptr _state){ SelectionMoleculeByFormulaState *state = assert_cast(_state.get()); World::getInstance().selectAllMolecules(MoleculeByFormula(state->params.formula)); return Action::state_ptr(_state); } bool SelectionMoleculeByFormulaAction::canUndo() { return true; } bool SelectionMoleculeByFormulaAction::shouldUndo() { return true; } /** =========== end of function ====================== */