Adding_MD_integration_tests
Adding_StructOpt_integration_tests
AutomationFragmentation_failures
Candidate_v1.6.1
ChemicalSpaceEvaluator
Enhanced_StructuralOptimization
Enhanced_StructuralOptimization_continued
Exclude_Hydrogens_annealWithBondGraph
ForceAnnealing_with_BondGraph
ForceAnnealing_with_BondGraph_contraction-expansion
Gui_displays_atomic_force_velocity
JobMarket_RobustOnKillsSegFaults
JobMarket_StableWorkerPool
PythonUI_with_named_parameters
StoppableMakroAction
TremoloParser_IncreasedPrecision
Last change
on this file since 37fe17 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.
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-
Property mode
set to
100644
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File size:
1.9 KB
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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) 2010-2012 University of Bonn. All rights reserved.
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5 | *
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6 | *
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7 | * This file is part of MoleCuilder.
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8 | *
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9 | * MoleCuilder is free software: you can redistribute it and/or modify
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10 | * it under the terms of the GNU General Public License as published by
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11 | * the Free Software Foundation, either version 2 of the License, or
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12 | * (at your option) any later version.
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13 | *
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14 | * MoleCuilder is distributed in the hope that it will be useful,
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15 | * but WITHOUT ANY WARRANTY; without even the implied warranty of
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16 | * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
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17 | * GNU General Public License for more details.
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18 | *
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19 | * You should have received a copy of the GNU General Public License
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20 | * along with MoleCuilder. If not, see <http://www.gnu.org/licenses/>.
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21 | */
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22 |
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23 | /*
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24 | * GraphEdge.cpp
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25 | *
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26 | * Created on: Feb 25, 2011
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27 | * Author: heber
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28 | */
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29 |
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30 | // include config.h
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31 | #ifdef HAVE_CONFIG_H
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32 | #include <config.h>
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33 | #endif
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34 |
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35 | //#include "CodePatterns/MemDebug.hpp"
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36 |
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37 | #include <string>
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38 |
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39 | #include "Bond/GraphEdge.hpp"
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40 | #include "CodePatterns/Log.hpp"
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41 | #include "CodePatterns/Verbose.hpp"
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42 |
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43 | GraphEdge::GraphEdge() :
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44 | Cyclic(false),
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45 | Type(Undetermined),
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46 | Used(white)
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47 | {}
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48 |
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49 | GraphEdge::~GraphEdge()
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50 | {}
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51 |
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52 | enum GraphEdge::Shading GraphEdge::IsUsed()
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53 | {
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54 | return Used;
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55 | };
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56 |
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57 | bool GraphEdge::MarkUsed(const enum GraphEdge::Shading color)
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58 | {
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59 | if (Used == black) {
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60 | ELOG(1, "GraphEdge " << this << " was already marked black!.");
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61 | return false;
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62 | } else {
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63 | Used = color;
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64 | return true;
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65 | }
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66 | };
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67 |
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68 | void GraphEdge::ResetUsed()
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69 | {
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70 | Used = white;
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71 | };
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72 |
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73 | std::string GraphEdge::getColorName(enum Shading color)
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74 | {
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75 | switch (color) {
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76 | case white:
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77 | return "white";
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78 | break;
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79 | case lightgray:
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80 | return "lightgray";
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81 | break;
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82 | case darkgray:
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83 | return "darkgray";
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84 | break;
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85 | case black:
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86 | return "black";
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87 | break;
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88 | default:
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89 | return "uncolored";
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90 | break;
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91 | };
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92 | }
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