source: src/Actions/TesselationAction/NonConvexEnvelopeAction.cpp@ a844d8

Candidate_v1.6.1
Last change on this file since a844d8 was 9eb71b3, checked in by Frederik Heber <frederik.heber@…>, 8 years ago

Commented out MemDebug include and Memory::ignore.

  • MemDebug clashes with various allocation operators that use a specific placement in memory. It is so far not possible to wrap new/delete fully. Hence, we stop this effort which so far has forced us to put ever more includes (with clashes) into MemDebug and thereby bloat compilation time.
  • MemDebug does not add that much usefulness which is not also provided by valgrind.
  • Property mode set to 100644
File size: 3.6 KB
RevLine 
[bcf653]1/*
2 * Project: MoleCuilder
3 * Description: creates and alters molecular systems
[0aa122]4 * Copyright (C) 2010-2012 University of Bonn. All rights reserved.
[94d5ac6]5 *
6 *
7 * This file is part of MoleCuilder.
8 *
9 * MoleCuilder is free software: you can redistribute it and/or modify
10 * it under the terms of the GNU General Public License as published by
11 * the Free Software Foundation, either version 2 of the License, or
12 * (at your option) any later version.
13 *
14 * MoleCuilder is distributed in the hope that it will be useful,
15 * but WITHOUT ANY WARRANTY; without even the implied warranty of
16 * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
17 * GNU General Public License for more details.
18 *
19 * You should have received a copy of the GNU General Public License
20 * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
[bcf653]21 */
22
[97ebf8]23/*
24 * NonConvexEnvelopeAction.cpp
25 *
26 * Created on: May 10, 2010
27 * Author: heber
28 */
29
[bf3817]30// include config.h
31#ifdef HAVE_CONFIG_H
32#include <config.h>
33#endif
34
[9eb71b3]35//#include "CodePatterns/MemDebug.hpp"
[112b09]36
[ad011c]37#include "CodePatterns/Log.hpp"
[53c7fc]38#include "LinkedCell/linkedcell.hpp"
39#include "LinkedCell/PointCloudAdaptor.hpp"
[628b52]40#include "molecule.hpp"
[53c7fc]41#include "Tesselation/boundary.hpp"
[d127c8]42#include "Tesselation/tesselation.hpp"
[628b52]43#include "World.hpp"
[97ebf8]44
45#include <iostream>
46#include <string>
47
[1fd675]48#include "Actions/TesselationAction/NonConvexEnvelopeAction.hpp"
[ff4fd2a]49
[ce7fdc]50using namespace MoleCuilder;
51
[1fd675]52// and construct the stuff
53#include "NonConvexEnvelopeAction.def"
54#include "Action_impl_pre.hpp"
55/** =========== define the function ====================== */
[b5b01e]56ActionState::ptr TesselationNonConvexEnvelopeAction::performCall() {
[97ebf8]57 molecule * Boundary = NULL;
58 bool Success = false;
59 clock_t start,end;
60
[ff4fd2a]61 for (World::MoleculeSelectionIterator iter = World::getInstance().beginMoleculeSelection(); iter != World::getInstance().endMoleculeSelection(); ++iter) {
62 Boundary = iter->second;
[97ebf8]63 class Tesselation *T = NULL;
[6bd7e0]64 const LinkedCell_deprecated *LCList = NULL;
[47d041]65 LOG(0, "Evaluating non-convex envelope of molecule." << Boundary->getId());
[f10b0c]66 LOG(1, "Using rolling ball of radius " << params.SphereRadius.get() << " and storing tecplot data in " << params.filename.get() << ".");
[47d041]67 LOG(1, "Specified molecule has " << Boundary->getAtomCount() << " atoms.");
[97ebf8]68 start = clock();
[caa06ef]69 PointCloudAdaptor< molecule > cloud(Boundary, Boundary->name);
[f10b0c]70 LCList = new LinkedCell_deprecated(cloud, params.SphereRadius.get()*2.);
71 Success = FindNonConvexBorder(Boundary, T, LCList, params.SphereRadius.get(), params.filename.get().string().c_str());
72 //FindDistributionOfEllipsoids(T, &LCList, N, number, params.filename.get().c_str());
[97ebf8]73 end = clock();
[47d041]74 LOG(0, "Clocks for this operation: " << (end-start) << ", time: " << ((double)(end-start)/CLOCKS_PER_SEC) << "s.");
[97ebf8]75 delete(LCList);
76 delete(T);
77 }
[ff4fd2a]78 if (Success)
79 return Action::success;
80 else
81 return Action::failure;
[97ebf8]82}
83
[b5b01e]84ActionState::ptr TesselationNonConvexEnvelopeAction::performUndo(ActionState::ptr _state) {
[97ebf8]85// TesselationNonConvexEnvelopeState *state = assert_cast<TesselationNonConvexEnvelopeState*>(_state.get());
86
87// string newName = state->mol->getName();
88// state->mol->setName(state->lastName);
89
[26b4d62]90 STATUS("Undo of TesselationNonConvexEnvelopeAction not implemented.");
[97ebf8]91 return Action::failure;
92}
93
[b5b01e]94ActionState::ptr TesselationNonConvexEnvelopeAction::performRedo(ActionState::ptr _state){
[97ebf8]95 // Undo and redo have to do the same for this action
96 return performUndo(_state);
97}
98
99bool TesselationNonConvexEnvelopeAction::canUndo() {
100 return false;
101}
102
103bool TesselationNonConvexEnvelopeAction::shouldUndo() {
104 return false;
105}
[1fd675]106/** =========== end of function ====================== */
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