| [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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| [eaf4ae] | 20 | #include "Helpers/MemDebug.hpp"
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 | 21 | 
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 | 22 | #include "Helpers/Log.hpp"
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 | 23 | #include "Helpers/Verbose.hpp"
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 | 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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 | 43 |   molecule *mol = NULL;
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 | 44 | 
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| [1fd675] | 45 |   // obtain information
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 | 46 |   getParametersfromValueStorage();
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| [eaf4ae] | 47 | 
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 | 48 |   // check whether a single atom and molecule is selected
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| [90bc51] | 49 |   if (World::getInstance().getSelectedMolecules().size() != 1)
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| [eaf4ae] | 50 |     return Action::failure;
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 | 51 |   mol = World::getInstance().beginMoleculeSelection()->second;
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 | 52 | 
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| [90bc51] | 53 |   // check whether Axis is valid
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| [1fd675] | 54 |   if (params.Axis.IsZero())
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| [90bc51] | 55 |     return Action::failure;
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 | 56 | 
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 | 57 |   // convert from degrees to radian
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| [1fd675] | 58 |   params.angle *= M_PI/180.;
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| [90bc51] | 59 | 
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| [eaf4ae] | 60 |   // Creation Line that is the rotation axis
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 | 61 |   Vector *CenterOfGravity = mol->DetermineCenterOfGravity();
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| [1fd675] | 62 |   Line RotationAxis(*CenterOfGravity, params.Axis);
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| [eaf4ae] | 63 |   delete(CenterOfGravity);
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| [1fd675] | 64 |   DoLog(0) && (Log() << Verbose(0) << "Rotate around self by " << params.angle << " along " << RotationAxis << "." << endl);
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| [eaf4ae] | 65 | 
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 | 66 |   for (molecule::iterator iter = mol->begin(); iter != mol->end(); ++iter) {
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| [1fd675] | 67 |     (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), params.angle));
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| [eaf4ae] | 68 |   }
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 | 69 |   DoLog(0) && (Log() << Verbose(0) << "done." << endl);
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 | 70 | 
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| [1fd675] | 71 |   return Action::state_ptr(new MoleculeRotateAroundSelfByAngleState(mol, params));
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| [eaf4ae] | 72 | }
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 | 73 | 
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 | 74 | Action::state_ptr MoleculeRotateAroundSelfByAngleAction::performUndo(Action::state_ptr _state) {
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| [2204b0] | 75 |   MoleculeRotateAroundSelfByAngleState *state = assert_cast<MoleculeRotateAroundSelfByAngleState*>(_state.get());
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 | 76 | 
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 | 77 |   Vector *CenterOfGravity = state->mol->DetermineCenterOfGravity();
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| [1fd675] | 78 |   Line RotationAxis(*CenterOfGravity, state->params.Axis);
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| [2204b0] | 79 |   delete(CenterOfGravity);
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| [eaf4ae] | 80 | 
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| [2204b0] | 81 |   for (molecule::iterator iter = state->mol->begin(); iter != state->mol->end(); ++iter) {
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| [1fd675] | 82 |     (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), -state->params.angle));
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| [2204b0] | 83 |   }
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| [eaf4ae] | 84 | 
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| [2204b0] | 85 |   return Action::state_ptr(_state);
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| [eaf4ae] | 86 | }
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 | 87 | 
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 | 88 | Action::state_ptr MoleculeRotateAroundSelfByAngleAction::performRedo(Action::state_ptr _state){
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| [2204b0] | 89 |   MoleculeRotateAroundSelfByAngleState *state = assert_cast<MoleculeRotateAroundSelfByAngleState*>(_state.get());
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 | 90 | 
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 | 91 |   Vector *CenterOfGravity = state->mol->DetermineCenterOfGravity();
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| [1fd675] | 92 |   Line RotationAxis(*CenterOfGravity, state->params.Axis);
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| [2204b0] | 93 |   delete(CenterOfGravity);
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 | 94 | 
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 | 95 |   for (molecule::iterator iter = state->mol->begin(); iter != state->mol->end(); ++iter) {
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| [1fd675] | 96 |     (*iter)->setPosition(RotationAxis.rotateVector((*iter)->getPosition(), state->params.angle));
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| [2204b0] | 97 |   }
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 | 98 | 
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 | 99 |   return Action::state_ptr(_state);
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| [eaf4ae] | 100 | }
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 | 101 | 
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 | 102 | bool MoleculeRotateAroundSelfByAngleAction::canUndo() {
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| [2204b0] | 103 |   return true;
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| [eaf4ae] | 104 | }
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 | 105 | 
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 | 106 | bool MoleculeRotateAroundSelfByAngleAction::shouldUndo() {
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| [2204b0] | 107 |   return true;
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| [eaf4ae] | 108 | }
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| [1fd675] | 109 | /** =========== end of function ====================== */
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