| 1 | # PLEASE adhere to the alphabetical ordering in this Makefile!
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| 2 | # Also indentation by a single tab
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| 3 |
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| 4 | SUBDIRS = Actions UIElements
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| 5 |
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| 6 | # this includes source files that need to be present at multiple points
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| 7 | HELPERSOURCE = \
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| 8 | Helpers/Assert.cpp \
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| 9 | Helpers/MemDebug.cpp
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| 10 |
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| 11 | ATOMSOURCE = \
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| 12 | atom.cpp \
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| 13 | atom_atominfo.cpp \
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| 14 | atom_bondedparticle.cpp \
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| 15 | atom_bondedparticleinfo.cpp \
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| 16 | atom_graphnode.cpp \
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| 17 | atom_graphnodeinfo.cpp \
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| 18 | atom_particleinfo.cpp \
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| 19 | atom_trajectoryparticle.cpp \
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| 20 | atom_trajectoryparticleinfo.cpp
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| 21 | ATOMHEADER = \
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| 22 | atom.hpp \
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| 23 | atom_atominfo.hpp \
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| 24 | atom_bondedparticle.hpp \
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| 25 | atom_bondedparticleinfo.hpp \
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| 26 | atom_graphnode.hpp \
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| 27 | atom_graphnodeinfo.hpp \
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| 28 | atom_particleinfo.hpp \
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| 29 | atom_trajectoryparticle.hpp \
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| 30 | atom_trajectoryparticleinfo.hpp
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| 31 |
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| 32 | LINALGSOURCE = \
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| 33 | ${HELPERSOURCE} \
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| 34 | gslmatrix.cpp \
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| 35 | gslvector.cpp \
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| 36 | linearsystemofequations.cpp \
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| 37 | Space.cpp \
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| 38 | vector.cpp
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| 39 |
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| 40 | LINALGHEADER = gslmatrix.hpp \
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| 41 | gslvector.hpp \
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| 42 | linearsystemofequations.hpp \
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| 43 | Space.hpp \
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| 44 | vector.hpp
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| 45 |
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| 46 | ANALYSISSOURCE = \
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| 47 | analysis_bonds.cpp \
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| 48 | analysis_correlation.cpp
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| 49 | ANALYSISHEADER = \
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| 50 | analysis_bonds.hpp \
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| 51 | analysis_correlation.hpp
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| 52 |
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| 53 | ACTIONSSOURCE = \
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| 54 | Actions/Action.cpp \
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| 55 | Actions/ActionHistory.cpp \
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| 56 | Actions/ActionRegistry.cpp \
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| 57 | Actions/ActionSequence.cpp \
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| 58 | Actions/ErrorAction.cpp \
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| 59 | Actions/MakroAction.cpp \
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| 60 | Actions/ManipulateAtomsProcess.cpp \
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| 61 | Actions/MethodAction.cpp \
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| 62 | Actions/Process.cpp
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| 63 |
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| 64 | ACTIONSHEADER = \
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| 65 | Actions/Action.hpp \
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| 66 | Actions/ActionHistory.hpp \
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| 67 | Actions/ActionRegistry.hpp \
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| 68 | Actions/ActionSequence.hpp \
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| 69 | Actions/Calculation.hpp \
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| 70 | Actions/Calculation_impl.hpp \
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| 71 | Actions/ErrorAction.hpp \
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| 72 | Actions/MakroAction.hpp \
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| 73 | Actions/ManipulateAtomsProcess.hpp \
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| 74 | Actions/MapOfActions.hpp \
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| 75 | Actions/MethodAction.hpp \
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| 76 | Actions/Process.hpp
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| 77 |
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| 78 |
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| 79 | PARSERSOURCE = \
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| 80 | Parser/ChangeTracker.cpp \
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| 81 | Parser/FormatParser.cpp \
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| 82 | Parser/FormatParserStorage.cpp \
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| 83 | Parser/MpqcParser.cpp \
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| 84 | Parser/PcpParser.cpp \
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| 85 | Parser/TremoloParser.cpp \
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| 86 | Parser/XyzParser.cpp
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| 87 |
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| 88 | PARSERHEADER = \
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| 89 | Parser/ChangeTracker.hpp \
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| 90 | Parser/FormatParser.hpp \
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| 91 | Parser/FormatParserStorage.hpp \
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| 92 | Parser/MpqcParser.hpp \
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| 93 | Parser/PcpParser.hpp \
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| 94 | Parser/TremoloParser.hpp \
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| 95 | Parser/XyzParser.hpp
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| 96 |
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| 97 | PATTERNSOURCE = \
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| 98 | Patterns/Observer.cpp
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| 99 | PATTERNHEADER = \
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| 100 | Patterns/Cacheable.hpp \
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| 101 | Patterns/Observer.hpp \
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| 102 | Patterns/Singleton.hpp
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| 103 |
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| 104 | # all these files are only used for legacy reasons while the transition is in progress
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| 105 | # they are only needed to keep the program usable at any point of the transition and will be
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| 106 | # deleted once everything is fully refactored
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| 107 | LEGACYSOURCE = Legacy/oldmenu.cpp
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| 108 | LEGACYHEADER = Legacy/oldmenu.hpp
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| 109 |
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| 110 | QTUIMOC_HEADER = UIElements/QT4/QTDialog.hpp \
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| 111 | UIElements/QT4/QTMainWindow.hpp \
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| 112 | UIElements/Menu/QT4/QTMenu.hpp \
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| 113 | UIElements/Views/QT4/QTWorldView.hpp \
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| 114 | UIElements/Views/QT4/GLMoleculeView.hpp \
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| 115 | UIElements/Views/QT4/QTMoleculeView.hpp \
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| 116 | UIElements/Views/QT4/QTStatusBar.hpp
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| 117 |
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| 118 | QTUIMOC_TARGETS = QTMainWindow.moc.cpp \
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| 119 | QTMenu.moc.cpp\
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| 120 | QTDialog.moc.cpp \
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| 121 | QTWorldView.moc.cpp \
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| 122 | GLMoleculeView.moc.cpp \
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| 123 | QTMoleculeView.moc.cpp \
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| 124 | QTStatusBar.moc.cpp
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| 125 |
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| 126 | DESCRIPTORSOURCE = Descriptors/AtomDescriptor.cpp \
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| 127 | Descriptors/AtomIdDescriptor.cpp \
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| 128 | Descriptors/AtomTypeDescriptor.cpp \
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| 129 | Descriptors/MoleculeDescriptor.cpp \
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| 130 | Descriptors/MoleculeIdDescriptor.cpp \
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| 131 | Descriptors/MoleculeNameDescriptor.cpp \
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| 132 | Descriptors/MoleculePtrDescriptor.cpp
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| 133 |
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| 134 |
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| 135 | DESCRIPTORHEADER = Descriptors/AtomDescriptor.hpp \
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| 136 | Descriptors/AtomIdDescriptor.hpp \
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| 137 | Descriptors/AtomTypeDescriptor.hpp \
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| 138 | Descriptors/MoleculeDescriptor.hpp \
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| 139 | Descriptors/MoleculeIdDescriptor.hpp \
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| 140 | Descriptors/MoleculeNameDescriptor.hpp \
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| 141 | Descriptors/MoleculePtrDescriptor.hpp
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| 142 |
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| 143 | EXCEPTIONSOURCE = Exceptions/CustomException.cpp \
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| 144 | Exceptions/LinearDependenceException.cpp \
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| 145 | Exceptions/MathException.cpp \
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| 146 | Exceptions/SkewException.cpp \
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| 147 | Exceptions/ZeroVectorException.cpp
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| 148 |
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| 149 | EXCEPTIONHEADER = Exceptions/CustomException.hpp \
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| 150 | Exceptions/LinearDependenceException.hpp \
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| 151 | Exceptions/MathException.hpp \
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| 152 | Exceptions/SkewException.hpp \
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| 153 | Exceptions/ZeroVectorException.hpp
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| 154 |
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| 155 | QTUISOURCE = ${QTUIMOC_TARGETS} \
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| 156 | UIElements/QT4/QTMainWindow.cpp \
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| 157 | UIElements/QT4/QTDialog.cpp \
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| 158 | UIElements/QT4/QTUIFactory.cpp \
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| 159 | UIElements/Menu/QT4/QTMenu.cpp \
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| 160 | UIElements/Views/QT4/QTWorldView.cpp \
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| 161 | UIElements/Views/QT4/GLMoleculeView.cpp \
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| 162 | UIElements/Views/QT4/QTMoleculeView.cpp \
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| 163 | UIElements/Views/QT4/QTStatusBar.cpp
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| 164 |
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| 165 | QTUIHEADER = ${QTUIMOC_HEADER} UIElements/QT4/QTUIFactory.hpp
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| 166 |
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| 167 | QTUI_DEFS =
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| 168 |
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| 169 | SOURCE = \
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| 170 | ${ANALYSISSOURCE} \
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| 171 | ${ACTIONSSOURCE} \
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| 172 | ${ATOMSOURCE} \
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| 173 | ${PATTERNSOURCE} \
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| 174 | ${PARSERSOURCE} \
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| 175 | ${DESCRIPTORSOURCE} \
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| 176 | ${HELPERSOURCE} \
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| 177 | ${LEGACYSOURCE} \
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| 178 | ${EXCEPTIONSOURCE} \
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| 179 | bond.cpp \
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| 180 | bondgraph.cpp \
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| 181 | boundary.cpp \
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| 182 | CommandLineParser.cpp \
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| 183 | config.cpp \
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| 184 | ConfigFileBuffer.cpp \
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| 185 | element.cpp \
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| 186 | elements_db.cpp \
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| 187 | ellipsoid.cpp \
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| 188 | errorlogger.cpp \
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| 189 | graph.cpp \
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| 190 | helpers.cpp \
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| 191 | info.cpp \
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| 192 | leastsquaremin.cpp \
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| 193 | Line.cpp \
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| 194 | linkedcell.cpp \
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| 195 | log.cpp \
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| 196 | logger.cpp \
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| 197 | moleculelist.cpp \
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| 198 | molecule.cpp \
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| 199 | molecule_dynamics.cpp \
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| 200 | molecule_fragmentation.cpp \
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| 201 | molecule_geometry.cpp \
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| 202 | molecule_graph.cpp \
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| 203 | molecule_pointcloud.cpp \
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| 204 | parser.cpp \
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| 205 | periodentafel.cpp \
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| 206 | Plane.cpp \
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| 207 | Space.cpp \
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| 208 | tesselation.cpp \
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| 209 | tesselationhelpers.cpp \
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| 210 | ThermoStatContainer.cpp \
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| 211 | triangleintersectionlist.cpp \
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| 212 | vector.cpp \
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| 213 | vector_ops.cpp \
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| 214 | verbose.cpp \
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| 215 | World.cpp
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| 216 |
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| 217 | HEADER = \
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| 218 | ${ANALYSISHEADER} \
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| 219 | ${ACTIONSHEADER} \
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| 220 | ${ATOMHEADER} \
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| 221 | ${PARSERHEADER} \
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| 222 | ${PATTERNHEADER} \
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| 223 | ${DESCRIPTORHEADER} \
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| 224 | ${EXCEPTIONHEADER} \
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| 225 | ${LEGACYHEADER} \
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| 226 | bond.hpp \
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| 227 | bondgraph.hpp \
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| 228 | boundary.hpp \
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| 229 | CommandLineParser.hpp \
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| 230 | config.hpp \
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| 231 | ConfigFileBuffer.hpp \
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| 232 | defs.hpp \
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| 233 | element.hpp \
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| 234 | elements_db.hpp \
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| 235 | ellipsoid.hpp \
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| 236 | errorlogger.hpp \
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| 237 | graph.hpp \
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| 238 | helpers.hpp \
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| 239 | info.hpp \
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| 240 | leastsquaremin.hpp \
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| 241 | Line.hpp \
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| 242 | linkedcell.hpp \
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| 243 | lists.hpp \
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| 244 | log.hpp \
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| 245 | logger.hpp \
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| 246 | molecule.hpp \
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| 247 | molecule_template.hpp \
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| 248 | parser.hpp \
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| 249 | periodentafel.hpp \
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| 250 | Plane.hpp \
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| 251 | stackclass.hpp \
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| 252 | tesselation.hpp \
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| 253 | tesselationhelpers.hpp \
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| 254 | ThermoStatContainer.hpp \
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| 255 | triangleintersectionlist.hpp \
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| 256 | verbose.hpp \
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| 257 | vector_ops.hpp \
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| 258 | World.hpp
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| 259 |
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| 260 | # the following files are no longer used:
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| 261 | # memoryallocator.hpp \
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| 262 | # memoryallocator.cpp \
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| 263 | # memoryusageobserver.hpp \
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| 264 | # memoryusageobserver.cpp
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| 265 |
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| 266 | BOOST_LIB = $(BOOST_LDFLAGS) $(BOOST_MPL_LIB)
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| 267 | GUI_LIBS = ${QT_LDADD} ${QT_LIB_GUI} -lQtOpenGL ${GLU_LIBS}
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| 268 | INCLUDES = -I$(top_srcdir)/src/unittests -I$(top_srcdir)/src/Actions -I$(top_srcdir)/src/UIElements
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| 269 |
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| 270 | noinst_LIBRARIES = libmolecuilder.a libgslwrapper.a libmenu.a libparser.a
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| 271 | bin_PROGRAMS = molecuilder molecuildergui joiner analyzer
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| 272 |
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| 273 | molecuilderdir = ${bindir}
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| 274 |
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| 275 | libmolecuilder_a_SOURCES = ${SOURCE} ${HEADER}
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| 276 |
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| 277 | libmenu_a_SOURCES = ${UISOURCE} ${UIHEADER}
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| 278 | libparser_a_SOURCES = ${PARSERSOURCE} ${PARSERHEADER}
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| 279 | libgslwrapper_a_SOURCES = ${LINALGSOURCE} ${LINALGHEADER}
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| 280 |
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| 281 | molecuilder_DATA = elements.db valence.db orbitals.db Hbonddistance.db Hbondangle.db
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| 282 |
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| 283 | molecuilder_CXXFLAGS = $(BOOST_CPPFLAGS)
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| 284 | #molecuilder_CXXFLAGS += -DNO_CACHING
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| 285 | molecuilder_LDFLAGS = $(BOOST_LIB)
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| 286 | molecuilder_SOURCES = ${LEGACYSOURCE} builder.cpp
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| 287 | molecuilder_SOURCES += $(srcdir)/version.c
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| 288 | molecuilder_LDADD = UIElements/libMolecuilderUI.a Actions/libMolecuilderActions.a libmolecuilder.a libparser.a libgslwrapper.a $(BOOST_LIB) ${BOOST_THREAD_LIB} ${BOOST_PROGRAM_OPTIONS_LIB}
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| 289 |
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| 290 | #Stuff for building the GUI using QT
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| 291 | molecuildergui_SOURCES = ${QTUISOURCE} ${LEGACYSOURCE} builder.cpp
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| 292 | molecuildergui_SOURCES += $(srcdir)/version.c
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| 293 | molecuildergui_CXXFLAGS = ${QT_CXXFLAGS} ${GLU_CXXFLAGS} -DUSE_GUI_QT
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| 294 | molecuildergui_LDFLAGS = $(BOOST_LIB) ${QT_LDFLAGS} ${GLU_LDFLAGS}
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| 295 | molecuildergui_LDADD = UIElements/libMolecuilderUI.a Actions/libMolecuilderActions.a libmolecuilder.a libparser.a libgslwrapper.a $(BOOST_LIB) ${BOOST_THREAD_LIB} ${BOOST_PROGRAM_OPTIONS_LIB} ${GUI_LIBS}
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| 296 |
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| 297 | joiner_SOURCES = joiner.cpp datacreator.cpp parser.cpp datacreator.hpp helpers.hpp parser.hpp periodentafel.hpp
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| 298 | joiner_LDADD = libmolecuilder.a $(BOOST_LIB) ${BOOST_THREAD_LIB}
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| 299 |
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| 300 | analyzer_SOURCES = analyzer.cpp datacreator.cpp parser.cpp helpers.hpp periodentafel.hpp parser.hpp datacreator.hpp
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| 301 | analyzer_LDADD = libmolecuilder.a $(BOOST_LIB) ${BOOST_THREAD_LIB}
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| 302 |
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| 303 | #Rules needed for QT4
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| 304 | # UI-Files are scattered throughout several subdirectories
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| 305 | # Therfore `%'-rules do not seem to work
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| 306 | #Quick fix to get it done otherwise
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| 307 | ${QTUIMOC_TARGETS}: ${QTUIMOC_HEADER}
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| 308 | list='$(QTUIMOC_HEADER)'; for header in $$list; do \
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| 309 | echo "Making mocfile for $$header"; \
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| 310 | target=`basename $$header | sed "s/\(.*\)\..*/\1.moc.cpp/"`;\
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| 311 | $(MOC) $(srcdir)/$$header -o $$target \
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| 312 | || eval $$failcom; \
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| 313 | done;
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| 314 |
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| 315 | MOSTLYCLEANFILES = ${QTUIMOC_TARGETS}
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| 316 |
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| 317 | #EXTRA_DIST = ${molecuilder_DATA}
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| 318 |
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| 319 | FORCE:
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| 320 | $(srcdir)/.git-version: FORCE
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| 321 | @if (test -d $(top_srcdir)/../.git && cd $(srcdir) && git describe HEAD) > .git-version-t 2>/dev/null \
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| 322 | && ! diff .git-version-t $(srcdir)/.git-version >/dev/null 2>&1; then \
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| 323 | mv -f .git-version-t $(srcdir)/.git-version; \
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| 324 | else \
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| 325 | rm -f .git-version-t; \
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| 326 | fi
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| 327 |
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| 328 | EXTRA_DIST = $(srcdir)/.git-version
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| 329 |
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| 330 | $(srcdir)/version.c: $(srcdir)/.git-version
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| 331 | echo "const char *ESPACKVersion = \"$(PACKAGE_NAME) -- git version: "`cat $(srcdir)/.git-version`"\";" > $@
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| 332 |
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| 333 |
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