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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8 | /*
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9 | * ScaleBoxAction.cpp
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10 | *
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11 | * Created on: May 8, 2010
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12 | * Author: heber
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13 | */
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14 |
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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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20 | #include "CodePatterns/MemDebug.hpp"
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21 |
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22 | #include "atom.hpp"
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23 | #include "CodePatterns/Log.hpp"
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24 | #include "LinearAlgebra/Vector.hpp"
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25 | #include "CodePatterns/Verbose.hpp"
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26 | #include "World.hpp"
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27 | #include "Box.hpp"
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28 | #include "LinearAlgebra/RealSpaceMatrix.hpp"
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29 |
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30 | #include <iostream>
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31 | #include <string>
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32 |
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33 | using namespace std;
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34 |
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35 | #include "Actions/WorldAction/ScaleBoxAction.hpp"
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36 |
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37 | // and construct the stuff
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38 | #include "ScaleBoxAction.def"
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39 | #include "Action_impl_pre.hpp"
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40 | /** =========== define the function ====================== */
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41 | Action::state_ptr WorldScaleBoxAction::performCall() {
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42 | double x[NDIM];
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43 |
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44 | // obtain information
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45 | getParametersfromValueStorage();
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46 |
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47 | DoLog(1) && (Log() << Verbose(1) << "Scaling all atomic positions by factor." << endl);
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48 | for (int i=0;i<NDIM;i++)
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49 | x[i] = params.Scaler[i];
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50 | vector<atom*> AllAtoms = World::getInstance().getAllAtoms();
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51 | for(vector<atom*>::iterator AtomRunner = AllAtoms.begin(); AtomRunner != AllAtoms.end(); ++AtomRunner) {
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52 | (*AtomRunner)->ScaleAll(x);
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53 | }
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54 |
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55 | RealSpaceMatrix M = World::getInstance().getDomain().getM();
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56 | RealSpaceMatrix scale;
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57 |
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58 | for (int i=0;i<NDIM;i++) {
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59 | scale.at(i,i) = x[i];
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60 | }
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61 | M *= scale;
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62 | World::getInstance().setDomain(M);
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63 |
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64 | return Action::success;
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65 | }
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66 |
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67 | Action::state_ptr WorldScaleBoxAction::performUndo(Action::state_ptr _state) {
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68 | // ParserLoadXyzState *state = assert_cast<ParserLoadXyzState*>(_state.get());
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69 |
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70 | return Action::failure;
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71 | // string newName = state->mol->getName();
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72 | // state->mol->setName(state->lastName);
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73 | //
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74 | // return Action::state_ptr(new ParserLoadXyzState(state->mol,newName));
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75 | }
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76 |
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77 | Action::state_ptr WorldScaleBoxAction::performRedo(Action::state_ptr _state){
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78 | return Action::failure;
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79 | }
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80 |
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81 | bool WorldScaleBoxAction::canUndo() {
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82 | return false;
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83 | }
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84 |
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85 | bool WorldScaleBoxAction::shouldUndo() {
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86 | return false;
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87 | }
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88 | /** =========== end of function ====================== */
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