source: src/Actions/MoleculeAction/LinearInterpolationofTrajectoriesAction.cpp@ abae35

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Last change on this file since abae35 was ce7fdc, checked in by Frederik Heber <heber@…>, 13 years ago

HUGE: All Action-related codes resides now in namespace MoleCuilder.

  • removed all namespace std in Actions..., replaced by MoleCuilder.
  • Property mode set to 100644
File size: 2.5 KB
Line 
1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
4 * Copyright (C) 2010 University of Bonn. All rights reserved.
5 * Please see the LICENSE file or "Copyright notice" in builder.cpp for details.
6 */
7
8/*
9 * LinearInterpolationofTrajectoriesAction.cpp
10 *
11 * Created on: May 10, 2010
12 * Author: heber
13 */
14
15// include config.h
16#ifdef HAVE_CONFIG_H
17#include <config.h>
18#endif
19
20#include "CodePatterns/MemDebug.hpp"
21
22#include "atom.hpp"
23#include "Helpers/defs.hpp"
24#include "CodePatterns/Assert.hpp"
25#include "CodePatterns/Log.hpp"
26#include "CodePatterns/Verbose.hpp"
27#include "Dynamics/LinearInterpolationBetweenSteps.hpp"
28#include "molecule.hpp"
29#include "World.hpp"
30
31#include <vector>
32#include <iostream>
33#include <fstream>
34#include <string>
35
36#include "Actions/MoleculeAction/LinearInterpolationofTrajectoriesAction.hpp"
37
38using namespace MoleCuilder;
39
40// and construct the stuff
41#include "LinearInterpolationofTrajectoriesAction.def"
42#include "Action_impl_pre.hpp"
43/** =========== define the function ====================== */
44Action::state_ptr MoleculeLinearInterpolationofTrajectoriesAction::performCall() {
45 // obtain information
46 getParametersfromValueStorage();
47
48 LOG(0, "STATUS: Linear interpolation between configuration " << params.start << " and " << params.end << "." << endl);
49 ASSERT(params.end > params.start, "MoleculeLinearInterpolationofTrajectoriesAction() - start step greater than end step.");
50 AtomSetMixin<std::vector<atom*> > set(World::getInstance().getSelectedAtoms());
51 LinearInterpolationBetweenSteps<std::vector<atom*> > LinearInterpolate(set,(unsigned int)(params.interpolation_steps));
52 LinearInterpolate(params.start, params.end, params.IdMapping);
53 LOG(0, "STATUS: done." << endl);
54
55 return Action::success;
56}
57
58Action::state_ptr MoleculeLinearInterpolationofTrajectoriesAction::performUndo(Action::state_ptr _state) {
59// MoleculeLinearInterpolationofTrajectoriesState *state = assert_cast<MoleculeLinearInterpolationofTrajectoriesState*>(_state.get());
60
61// string newName = state->mol->getName();
62// state->mol->setName(state->lastName);
63
64 return Action::failure;
65}
66
67Action::state_ptr MoleculeLinearInterpolationofTrajectoriesAction::performRedo(Action::state_ptr _state){
68 // Undo and redo have to do the same for this action
69 return performUndo(_state);
70}
71
72bool MoleculeLinearInterpolationofTrajectoriesAction::canUndo() {
73 return false;
74}
75
76bool MoleculeLinearInterpolationofTrajectoriesAction::shouldUndo() {
77 return false;
78}
79/** =========== end of function ====================== */
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