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github.com/OpenChemistry/avogadrolibs
/ functions
Functions
5,508 in github.com/OpenChemistry/avogadrolibs
⨍
Functions
5,508
◇
Types & classes
1,034
↓ 1 callers
Method
setMolecule
avogadro/qtplugins/commandscripts/command.cpp:136
↓ 1 callers
Method
setMoleculeData
called by widget
avogadro/qtplugins/importpqr/importpqr.cpp:90
↓ 1 callers
Method
setOperations
avogadro/qtplugins/symmetry/operationstablemodel.cpp:33
↓ 1 callers
Function
setOptions
* @brief Set options for the file reader. * @param options The options, each reader chooses how to use/interpret them. */
avogadro/io/fileformat.h:189
↓ 1 callers
Method
setOptions
avogadro/qtplugins/forcefield/forcefielddialog.cpp:108
↓ 1 callers
Method
setOptions
avogadro/qtplugins/configurepython/configurepythondialog.cpp:155
↓ 1 callers
Method
setOptions
avogadro/qtplugins/openbabel/obforcefielddialog.cpp:104
↓ 1 callers
Method
setOrbitals
avogadro/qtplugins/surfaces/orbitaltablemodel.cpp:217
↓ 1 callers
Method
setPixelRatio
avogadro/rendering/glrenderer.cpp:85
↓ 1 callers
Method
setQueue
avogadro/molequeue/client/jobobject.cpp:27
↓ 1 callers
Method
setQueueList
avogadro/molequeue/molequeuequeuelistmodel.cpp:30
↓ 1 callers
Method
setQueueList
tests/qtgui/molequeuequeuelistmodeltest.cpp:24
↓ 1 callers
Method
setReadWriteFlags
* Set whether this format supports read and/or write operations. */
avogadro/qtplugins/openbabel/obfileformat.h:59
↓ 1 callers
Method
setRecommendedForceField
avogadro/qtplugins/forcefield/forcefielddialog.cpp:134
↓ 1 callers
Method
setRecommendedForceField
avogadro/qtplugins/openbabel/obforcefielddialog.cpp:285
↓ 1 callers
Method
setScriptFilePath
avogadro/qtgui/interfacescript.cpp:155
↓ 1 callers
Method
setSourceModel
avogadro/qtplugins/molecularproperties/molecularview.h:32
↓ 1 callers
Method
setSpinDensityMatrix
avogadro/core/gaussianset.cpp:173
↓ 1 callers
Method
setTextRenderStrategy
avogadro/rendering/glrenderer.cpp:186
↓ 1 callers
Method
setTextureData
avogadro/rendering/textlabelbase.cpp:91
↓ 1 callers
Method
setTextureSampler
avogadro/rendering/shaderprogram.cpp:268
↓ 1 callers
Method
setThreshold
avogadro/io/hdf5dataformat.cpp:203
↓ 1 callers
Method
setTickLabels
avogadro/qtgui/chartwidget.cpp:292
↓ 1 callers
Method
setTimeStep
avogadro/qtplugins/autoopt/csvrthermostat.h:105
↓ 1 callers
Method
setTriangles
avogadro/core/mesh.cpp:63
↓ 1 callers
Method
setUnderline
avogadro/rendering/textproperties.h:208
↓ 1 callers
Function
setVAlign
* Vertical alignment of the text. */
avogadro/rendering/textproperties.h:89
↓ 1 callers
Method
setViewWidget
avogadro/qtgui/containerwidget.cpp:45
↓ 1 callers
Method
setWrappingS
avogadro/rendering/texture2d.cpp:196
↓ 1 callers
Method
setWrappingT
avogadro/rendering/texture2d.cpp:214
↓ 1 callers
Method
setupBasis
avogadro/qtplugins/surfaces/surfacedialog.cpp:147
↓ 1 callers
Method
setupCubes
avogadro/qtplugins/surfaces/surfacedialog.cpp:196
↓ 1 callers
Method
setupModels
avogadro/qtplugins/surfaces/surfacedialog.cpp:245
↓ 1 callers
Method
setupSteps
avogadro/qtplugins/surfaces/surfacedialog.cpp:212
↓ 1 callers
Method
shellTypeFromString
avogadro/quantumio/gamessukout.cpp:120
↓ 1 callers
Method
smooth
avogadro/core/mesh.cpp:185
↓ 1 callers
Method
smoothingPassesValue
avogadro/qtplugins/surfaces/surfacedialog.cpp:287
↓ 1 callers
Function
spacing
* @return The spacing of the grid. */
avogadro/core/cube.h:64
↓ 1 callers
Method
step
avogadro/qtplugins/plotpdf/pdfoptionsdialog.cpp:33
↓ 1 callers
Function
stripLeadingNonJson
Strip any leading non-JSON output (e.g. deprecation warnings printed to stdout by third-party libraries). Find the first '{' or '['.
avogadro/qtgui/interfacescript.cpp:33
↓ 1 callers
Method
submitJobRequest
avogadro/molequeue/molequeuewidget.cpp:77
↓ 1 callers
Method
supportedOperations
tests/io/fileformatmanagertest.cpp:187
↓ 1 callers
Function
swap
avogadro/core/unitcell.h:196
↓ 1 callers
Function
swap
avogadro/rendering/ambientocclusionspheregeometry.h:111
↓ 1 callers
Function
swap
avogadro/rendering/arrowgeometry.h:118
↓ 1 callers
Function
swap
avogadro/rendering/volumegeometry.cpp:275
↓ 1 callers
Function
swap
avogadro/rendering/textlabelbase.h:95
↓ 1 callers
Function
swap
avogadro/rendering/linestripgeometry.h:128
↓ 1 callers
Function
swap
avogadro/rendering/cylindergeometry.h:165
↓ 1 callers
Function
swap
avogadro/rendering/widelinegeometry.h:189
↓ 1 callers
Function
swap
avogadro/rendering/spheregeometry.h:133
↓ 1 callers
Function
swap
avogadro/rendering/dashedlinegeometry.h:131
↓ 1 callers
Function
swap
avogadro/rendering/meshgeometry.h:144
↓ 1 callers
Method
swap
avogadro/core/array.h:330
↓ 1 callers
Method
swap
avogadro/rendering/textproperties.cpp:38
↓ 1 callers
Method
swapAtom
avogadro/qtgui/molecule.cpp:203
↓ 1 callers
Method
swapBond
avogadro/qtgui/molecule.cpp:194
↓ 1 callers
Method
swapEdgeIndices
avogadro/core/graph.cpp:402
↓ 1 callers
Method
swapLayer
avogadro/core/layer.cpp:121
↓ 1 callers
Method
swapVertexIndices
avogadro/core/graph.cpp:123
↓ 1 callers
Function
swap_endian
avogadro/io/dcdformat.cpp:47
↓ 1 callers
Function
swap_integer
avogadro/io/dcdformat.cpp:41
↓ 1 callers
Method
symmetrizeCell
avogadro/qtgui/rwmolecule.cpp:720
↓ 1 callers
Method
terminate
avogadro/qtplugins/qtaim/qtaimlsodaintegrator.cpp:761
↓ 1 callers
Function
test_simple
()
scripts/github-actions/simple_test.py:19
↓ 1 callers
Method
threshold
avogadro/io/hdf5dataformat.cpp:208
↓ 1 callers
Function
tomlArrayToVariantList
avogadro/qtgui/tomlparse.cpp:38
↓ 1 callers
Method
torsionEnergies
avogadro/calc/uff.cpp:1028
↓ 1 callers
Function
torsionTypeString
avogadro/qtplugins/propertytables/propertymodel.cpp:85
↓ 1 callers
Method
totalEnergy
avogadro/qtplugins/qtaim/qtaimwavefunction.h:247
↓ 1 callers
Method
transformAtoms
avogadro/qtplugins/crystal/volumescalingdialog.cpp:37
↓ 1 callers
Method
updateAxisColorsForTheme
avogadro/qtgui/chartwidget.cpp:33
↓ 1 callers
Method
updateConstraints
avogadro/qtplugins/constraints/constraintsdialog.cpp:105
↓ 1 callers
Function
validateBaseline
tests/qtopengl/qttextrenderstrategytest.cpp:81
↓ 1 callers
Method
valueCalls
tests/calc/energycalculatortest.cpp:120
↓ 1 callers
Method
vdwEnergies
avogadro/calc/uff.cpp:1035
↓ 1 callers
Method
version
avogadro/qtplugins/openbabel/obprocess.cpp:71
↓ 1 callers
Function
vertexCount
* Get the number of vertices. */
avogadro/rendering/meshgeometry.h:87
↓ 1 callers
Method
virialRatio
avogadro/qtplugins/qtaim/qtaimwavefunction.h:248
↓ 1 callers
Method
visible
avogadro/qtgui/rwlayermanager.cpp:230
↓ 1 callers
Method
waitForOutput
avogadro/qtplugins/openbabel/obcharges.cpp:31
↓ 1 callers
Method
wavelength
avogadro/qtplugins/plotxrd/xrdoptionsdialog.cpp:32
↓ 1 callers
Function
write
()
avogadro/qtplugins/scriptfileformats/formatScripts/zyx.py:24
↓ 1 callers
Method
writeFile
avogadro/io/fileformat.cpp:133
↓ 1 callers
Method
xGaussianPrimitiveAngularMomenta
avogadro/qtplugins/qtaim/qtaimwavefunction.h:181
↓ 1 callers
Method
xGaussianPrimitiveCenterCoordinates
avogadro/qtplugins/qtaim/qtaimwavefunction.h:156
↓ 1 callers
Method
xNuclearCoordinates
avogadro/qtplugins/qtaim/qtaimwavefunction.h:124
↓ 1 callers
Method
yGaussianPrimitiveAngularMomenta
avogadro/qtplugins/qtaim/qtaimwavefunction.h:185
↓ 1 callers
Method
yGaussianPrimitiveCenterCoordinates
avogadro/qtplugins/qtaim/qtaimwavefunction.h:160
↓ 1 callers
Method
yNuclearCoordinates
avogadro/qtplugins/qtaim/qtaimwavefunction.h:128
↓ 1 callers
Method
zGaussianPrimitiveAngularMomenta
avogadro/qtplugins/qtaim/qtaimwavefunction.h:189
↓ 1 callers
Method
zGaussianPrimitiveCenterCoordinates
avogadro/qtplugins/qtaim/qtaimwavefunction.h:164
↓ 1 callers
Method
zNuclearCoordinates
avogadro/qtplugins/qtaim/qtaimwavefunction.h:132
Method
ActiveLayerCommand
avogadro/qtgui/rwlayermanager.cpp:105
Method
AddAtomCommand
avogadro/qtgui/rwmolecule_undo.h:84
Method
AddBondCommand
avogadro/qtgui/rwmolecule_undo.h:415
Method
AddLayerCommand
avogadro/qtgui/rwlayermanager.cpp:31
Method
AddUnitCellCommand
avogadro/qtgui/rwmolecule_undo.h:567
Method
Alchemy
avogadro/qtplugins/alchemy/alchemy.cpp:23
Method
AlignTool
avogadro/qtplugins/aligntool/aligntool.cpp:46
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