| [bcf653] | 1 | /* | 
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|  | 2 | * Project: MoleCuilder | 
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|  | 3 | * Description: creates and alters molecular systems | 
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| [d103d3] | 4 | * Copyright (C)  2010-2011 University of Bonn. All rights reserved. | 
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| [bcf653] | 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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| [1cc87e] | 8 | /* | 
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|  | 9 | * AllAtomsInsideCuboidAction.cpp | 
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|  | 10 | * | 
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|  | 11 | *  Created on: Aug 9, 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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| [ad011c] | 20 | #include "CodePatterns/MemDebug.hpp" | 
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| [1cc87e] | 21 |  | 
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|  | 22 | #include "Descriptors/AtomShapeDescriptor.hpp" | 
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| [92d756] | 23 | #include "Descriptors/AtomSelectionDescriptor.hpp" | 
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| [1cc87e] | 24 | #include "atom.hpp" | 
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| [ad011c] | 25 | #include "CodePatterns/Log.hpp" | 
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|  | 26 | #include "CodePatterns/Verbose.hpp" | 
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| [cca9ef] | 27 | #include "LinearAlgebra/RealSpaceMatrix.hpp" | 
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| [1cc87e] | 28 | #include "LinearAlgebra/Vector.hpp" | 
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|  | 29 | #include "Shapes/BaseShapes.hpp" | 
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|  | 30 | #include "Shapes/Shape.hpp" | 
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|  | 31 | #include "Shapes/ShapeOps.hpp" | 
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|  | 32 | #include "World.hpp" | 
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|  | 33 |  | 
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| [92d756] | 34 | #include <boost/foreach.hpp> | 
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| [1cc87e] | 35 | #include <iostream> | 
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|  | 36 | #include <string> | 
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|  | 37 |  | 
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| [125002] | 38 | #include "AllAtomsInsideCuboidAction.hpp" | 
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| [1cc87e] | 39 |  | 
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| [ce7fdc] | 40 | using namespace MoleCuilder; | 
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|  | 41 |  | 
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| [1fd675] | 42 | // and construct the stuff | 
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|  | 43 | #include "AllAtomsInsideCuboidAction.def" | 
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|  | 44 | #include "Action_impl_pre.hpp" | 
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|  | 45 | /** =========== define the function ====================== */ | 
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| [1cc87e] | 46 | Action::state_ptr SelectionAllAtomsInsideCuboidAction::performCall() { | 
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| [cca9ef] | 47 | RealSpaceMatrix RotationMatrix; | 
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| [1cc87e] | 48 |  | 
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| [1fd675] | 49 | // obtain information | 
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|  | 50 | getParametersfromValueStorage(); | 
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|  | 51 |  | 
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| [9eb7580] | 52 | RotationMatrix.setRotation(params.Xangle, params.Yangle, params.Zangle); | 
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| [1fd675] | 53 |  | 
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| [47d041] | 54 | LOG(1, "Selecting all atoms inside a rotated " << RotationMatrix << " cuboid at " << params.position << " and extension of " << params.extension << "."); | 
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| [1fd675] | 55 | Shape s = translate(transform(stretch(Cuboid(),params.extension),RotationMatrix),params.position); | 
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| [92d756] | 56 | std::vector<atom *> selectedAtoms = World::getInstance().getAllAtoms(AtomsBySelection() && AtomByShape(s)); | 
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| [1cc87e] | 57 | World::getInstance().selectAllAtoms(AtomByShape(s)); | 
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| [47d041] | 58 | LOG(0, World::getInstance().countSelectedAtoms() << " atoms selected."); | 
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| [92d756] | 59 | return Action::state_ptr(new SelectionAllAtomsInsideCuboidState(selectedAtoms, s, params)); | 
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| [1cc87e] | 60 | } | 
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|  | 61 |  | 
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|  | 62 | Action::state_ptr SelectionAllAtomsInsideCuboidAction::performUndo(Action::state_ptr _state) { | 
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|  | 63 | SelectionAllAtomsInsideCuboidState *state = assert_cast<SelectionAllAtomsInsideCuboidState*>(_state.get()); | 
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|  | 64 |  | 
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| [92d756] | 65 | World::getInstance().unselectAllAtoms(AtomByShape(state->s)); | 
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|  | 66 | BOOST_FOREACH(atom *_atom, state->selectedAtoms) | 
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|  | 67 | World::getInstance().selectAtom(_atom); | 
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| [1cc87e] | 68 |  | 
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| [31fb1d] | 69 | return Action::state_ptr(_state); | 
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| [1cc87e] | 70 | } | 
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|  | 71 |  | 
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|  | 72 | Action::state_ptr SelectionAllAtomsInsideCuboidAction::performRedo(Action::state_ptr _state){ | 
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|  | 73 | SelectionAllAtomsInsideCuboidState *state = assert_cast<SelectionAllAtomsInsideCuboidState*>(_state.get()); | 
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| [cca9ef] | 74 | RealSpaceMatrix RotationMatrix; | 
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| [1cc87e] | 75 |  | 
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| [92d756] | 76 | World::getInstance().selectAllAtoms(AtomByShape(state->s)); | 
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| [1cc87e] | 77 |  | 
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| [31fb1d] | 78 | return Action::state_ptr(_state); | 
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| [1cc87e] | 79 | } | 
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|  | 80 |  | 
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|  | 81 | bool SelectionAllAtomsInsideCuboidAction::canUndo() { | 
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|  | 82 | return true; | 
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|  | 83 | } | 
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|  | 84 |  | 
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|  | 85 | bool SelectionAllAtomsInsideCuboidAction::shouldUndo() { | 
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|  | 86 | return true; | 
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|  | 87 | } | 
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| [1fd675] | 88 | /** =========== end of function ====================== */ | 
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