[bcf653] | 1 | /*
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| 2 | * Project: MoleCuilder
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| 3 | * Description: creates and alters molecular systems
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[0aa122] | 4 | * Copyright (C) 2010-2012 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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[6f0841] | 24 | #include "Atom/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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[f10b0c] | 49 | RotationMatrix.setRotation(params.Xangle.get(), params.Yangle.get(), params.Zangle.get());
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[1fd675] | 50 |
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[f10b0c] | 51 | LOG(1, "Selecting all atoms inside a rotated " << RotationMatrix << " cuboid at " << params.position.get() << " and extension of " << params.extension.get() << ".");
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| 52 | Shape s = translate(transform(stretch(Cuboid(),params.extension.get()),RotationMatrix),params.position.get());
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[d927ab] | 53 | std::vector<atom *> selectedAtoms = World::getInstance().getAllAtoms(AtomsBySelection() && AtomsByShape(s));
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| 54 | World::getInstance().selectAllAtoms(AtomsByShape(s));
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[47d041] | 55 | LOG(0, World::getInstance().countSelectedAtoms() << " atoms selected.");
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[92d756] | 56 | return Action::state_ptr(new SelectionAllAtomsInsideCuboidState(selectedAtoms, s, params));
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[1cc87e] | 57 | }
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| 58 |
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| 59 | Action::state_ptr SelectionAllAtomsInsideCuboidAction::performUndo(Action::state_ptr _state) {
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| 60 | SelectionAllAtomsInsideCuboidState *state = assert_cast<SelectionAllAtomsInsideCuboidState*>(_state.get());
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| 61 |
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[d927ab] | 62 | World::getInstance().unselectAllAtoms(AtomsByShape(state->s));
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[92d756] | 63 | BOOST_FOREACH(atom *_atom, state->selectedAtoms)
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| 64 | World::getInstance().selectAtom(_atom);
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[1cc87e] | 65 |
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[31fb1d] | 66 | return Action::state_ptr(_state);
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[1cc87e] | 67 | }
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| 68 |
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| 69 | Action::state_ptr SelectionAllAtomsInsideCuboidAction::performRedo(Action::state_ptr _state){
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| 70 | SelectionAllAtomsInsideCuboidState *state = assert_cast<SelectionAllAtomsInsideCuboidState*>(_state.get());
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[cca9ef] | 71 | RealSpaceMatrix RotationMatrix;
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[1cc87e] | 72 |
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[d927ab] | 73 | World::getInstance().selectAllAtoms(AtomsByShape(state->s));
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[1cc87e] | 74 |
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[31fb1d] | 75 | return Action::state_ptr(_state);
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[1cc87e] | 76 | }
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| 77 |
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| 78 | bool SelectionAllAtomsInsideCuboidAction::canUndo() {
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| 79 | return true;
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| 80 | }
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| 81 |
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| 82 | bool SelectionAllAtomsInsideCuboidAction::shouldUndo() {
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| 83 | return true;
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| 84 | }
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[1fd675] | 85 | /** =========== end of function ====================== */
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