source: src/Actions/TesselationAction/NonConvexEnvelopeAction.cpp@ ce7fdc

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Last change on this file since ce7fdc 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: 3.1 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 * NonConvexEnvelopeAction.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 "boundary.hpp"
23#include "CodePatterns/Log.hpp"
24#include "CodePatterns/Verbose.hpp"
25#include "linkedcell.hpp"
26#include "molecule.hpp"
27#include "PointCloudAdaptor.hpp"
28#include "tesselation.hpp"
29#include "World.hpp"
30
31#include <iostream>
32#include <string>
33
34#include "Actions/TesselationAction/NonConvexEnvelopeAction.hpp"
35
36using namespace MoleCuilder;
37
38// and construct the stuff
39#include "NonConvexEnvelopeAction.def"
40#include "Action_impl_pre.hpp"
41/** =========== define the function ====================== */
42Action::state_ptr TesselationNonConvexEnvelopeAction::performCall() {
43 molecule * Boundary = NULL;
44 bool Success = false;
45 clock_t start,end;
46
47 // obtain information
48 getParametersfromValueStorage();
49
50 for (World::MoleculeSelectionIterator iter = World::getInstance().beginMoleculeSelection(); iter != World::getInstance().endMoleculeSelection(); ++iter) {
51 Boundary = iter->second;
52 class Tesselation *T = NULL;
53 const LinkedCell *LCList = NULL;
54 DoLog(0) && (Log() << Verbose(0) << "Evaluating non-convex envelope of molecule." << Boundary->getId() << endl);
55 DoLog(1) && (Log() << Verbose(1) << "Using rolling ball of radius " << params.SphereRadius << " and storing tecplot data in " << params.filename << "." << endl);
56 DoLog(1) && (Log() << Verbose(1) << "Specified molecule has " << Boundary->getAtomCount() << " atoms." << endl);
57 start = clock();
58 PointCloudAdaptor< molecule > cloud(Boundary, Boundary->name);
59 LCList = new LinkedCell(cloud, params.SphereRadius*2.);
60 Success = FindNonConvexBorder(Boundary, T, LCList, params.SphereRadius, params.filename.string().c_str());
61 //FindDistributionOfEllipsoids(T, &LCList, N, number, params.filename.c_str());
62 end = clock();
63 DoLog(0) && (Log() << Verbose(0) << "Clocks for this operation: " << (end-start) << ", time: " << ((double)(end-start)/CLOCKS_PER_SEC) << "s." << endl);
64 delete(LCList);
65 delete(T);
66 }
67 if (Success)
68 return Action::success;
69 else
70 return Action::failure;
71}
72
73Action::state_ptr TesselationNonConvexEnvelopeAction::performUndo(Action::state_ptr _state) {
74// TesselationNonConvexEnvelopeState *state = assert_cast<TesselationNonConvexEnvelopeState*>(_state.get());
75
76// string newName = state->mol->getName();
77// state->mol->setName(state->lastName);
78
79 return Action::failure;
80}
81
82Action::state_ptr TesselationNonConvexEnvelopeAction::performRedo(Action::state_ptr _state){
83 // Undo and redo have to do the same for this action
84 return performUndo(_state);
85}
86
87bool TesselationNonConvexEnvelopeAction::canUndo() {
88 return false;
89}
90
91bool TesselationNonConvexEnvelopeAction::shouldUndo() {
92 return false;
93}
94/** =========== end of function ====================== */
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