[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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[eaf4ae] | 8 | /*
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| 9 | * RotateAroundSelfByAngleAction.cpp
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| 10 | *
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| 11 | * Created on: Aug 06, 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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[eaf4ae] | 21 |
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[ad011c] | 22 | #include "CodePatterns/Log.hpp"
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| 23 | #include "CodePatterns/Verbose.hpp"
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[eaf4ae] | 24 | #include "LinearAlgebra/Line.hpp"
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| 25 | #include "LinearAlgebra/Vector.hpp"
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| 26 | #include "atom.hpp"
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| 27 | #include "molecule.hpp"
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| 28 |
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| 29 |
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| 30 | #include <iostream>
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| 31 | #include <fstream>
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| 32 | #include <string>
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| 33 |
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| 34 | using namespace std;
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| 35 |
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[1fd675] | 36 | #include "Actions/MoleculeAction/RotateAroundSelfByAngleAction.hpp"
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[eaf4ae] | 37 |
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[1fd675] | 38 | // and construct the stuff
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| 39 | #include "RotateAroundSelfByAngleAction.def"
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| 40 | #include "Action_impl_pre.hpp"
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| 41 | /** =========== define the function ====================== */
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[eaf4ae] | 42 | Action::state_ptr MoleculeRotateAroundSelfByAngleAction::performCall() {
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[1fd675] | 43 | // obtain information
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| 44 | getParametersfromValueStorage();
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[eaf4ae] | 45 |
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[c00d35] | 46 | // check whether a molecule is selected
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| 47 | std::vector<molecule *> selectedMolecules = World::getInstance().getSelectedMolecules();
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| 48 | if (selectedMolecules.size() == 0)
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[90bc51] | 49 | return Action::failure;
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| 50 |
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[c00d35] | 51 | // go through all selected molecules
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| 52 | BOOST_FOREACH(molecule *mol, selectedMolecules) {
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| 53 | // check whether Axis is valid
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| 54 | if (params.Axis.IsZero())
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| 55 | return Action::failure;
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| 56 |
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| 57 | // convert from degrees to radian
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| 58 | params.angle *= M_PI/180.;
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| 59 |
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| 60 | // Creation Line that is the rotation axis
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| 61 | Vector *CenterOfGravity = mol->DetermineCenterOfGravity();
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[e69c87] | 62 | DoLog(0) && (Log() << Verbose(0) << "Center of gravity is " << *CenterOfGravity << "." << std::endl);
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[c00d35] | 63 | Line RotationAxis(*CenterOfGravity, params.Axis);
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| 64 | delete(CenterOfGravity);
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[9b8387] | 65 | DoLog(0) && (Log() << Verbose(0) << "Rotate " << mol->getName() << " around self by " << params.angle << " radian around axis " << RotationAxis << "." << endl);
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[c00d35] | 66 |
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| 67 | for (molecule::iterator iter = mol->begin(); iter != mol->end(); ++iter) {
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| 68 | (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), params.angle));
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| 69 | }
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| 70 | DoLog(0) && (Log() << Verbose(0) << "done." << endl);
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[eaf4ae] | 71 | }
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| 72 |
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[c00d35] | 73 | return Action::state_ptr(new MoleculeRotateAroundSelfByAngleState(selectedMolecules, params));
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[eaf4ae] | 74 | }
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| 75 |
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| 76 | Action::state_ptr MoleculeRotateAroundSelfByAngleAction::performUndo(Action::state_ptr _state) {
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[2204b0] | 77 | MoleculeRotateAroundSelfByAngleState *state = assert_cast<MoleculeRotateAroundSelfByAngleState*>(_state.get());
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| 78 |
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[c00d35] | 79 | BOOST_FOREACH(molecule *mol, state->selectedMolecules) {
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| 80 | Vector *CenterOfGravity = mol->DetermineCenterOfGravity();
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[e69c87] | 81 | DoLog(0) && (Log() << Verbose(0) << "Center of gravity is " << *CenterOfGravity << "." << std::endl);
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[c00d35] | 82 | Line RotationAxis(*CenterOfGravity, state->params.Axis);
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| 83 | delete(CenterOfGravity);
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[e69c87] | 84 | DoLog(0) && (Log() << Verbose(0) << "Rotate " << mol->getName() << " around self by " << -state->params.angle << " radian around axis " << RotationAxis << "." << endl);
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[eaf4ae] | 85 |
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[c00d35] | 86 | for (molecule::iterator iter = mol->begin(); iter != mol->end(); ++iter) {
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| 87 | (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), -state->params.angle));
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| 88 | }
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[2204b0] | 89 | }
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[eaf4ae] | 90 |
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[2204b0] | 91 | return Action::state_ptr(_state);
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[eaf4ae] | 92 | }
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| 93 |
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| 94 | Action::state_ptr MoleculeRotateAroundSelfByAngleAction::performRedo(Action::state_ptr _state){
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[2204b0] | 95 | MoleculeRotateAroundSelfByAngleState *state = assert_cast<MoleculeRotateAroundSelfByAngleState*>(_state.get());
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| 96 |
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[c00d35] | 97 | BOOST_FOREACH(molecule *mol, state->selectedMolecules) {
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| 98 | Vector *CenterOfGravity = mol->DetermineCenterOfGravity();
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[e69c87] | 99 | DoLog(0) && (Log() << Verbose(0) << "Center of gravity is " << *CenterOfGravity << "." << std::endl);
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[c00d35] | 100 | Line RotationAxis(*CenterOfGravity, state->params.Axis);
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| 101 | delete(CenterOfGravity);
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[e69c87] | 102 | DoLog(0) && (Log() << Verbose(0) << "Rotate " << mol->getName() << " around self by " << state->params.angle << " radian around axis " << RotationAxis << "." << endl);
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[2204b0] | 103 |
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[c00d35] | 104 | for (molecule::iterator iter = mol->begin(); iter != mol->end(); ++iter) {
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| 105 | (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), state->params.angle));
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| 106 | }
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[2204b0] | 107 | }
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| 108 |
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| 109 | return Action::state_ptr(_state);
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[eaf4ae] | 110 | }
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| 111 |
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| 112 | bool MoleculeRotateAroundSelfByAngleAction::canUndo() {
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[2204b0] | 113 | return true;
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[eaf4ae] | 114 | }
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| 115 |
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| 116 | bool MoleculeRotateAroundSelfByAngleAction::shouldUndo() {
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[2204b0] | 117 | return true;
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[eaf4ae] | 118 | }
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[1fd675] | 119 | /** =========== end of function ====================== */
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