NTSChem

Documentation by NanoTech Software GmbH


NTSChem Library Reference

Wed Apr 05 2006


Table of Contents

1. Front
2. Package base
Functions for Logging
Container Class std_vector_bool
Container Class std_vector_double
Container Class std_vector_float
Container Class std_vector_int
Container Class std_vector_string
Container Class std_vector_Vector3
Container Class std_vector_std_map_int_int
Functions for Vectors and Matrices
Class Matrix3x3
Class Vector3
3. Package framework
Class Object
Stored Properties of Class Object
Calculated Properties of Class Object
Commands of Class Object
Predicate Class IsVisible
Predicate Class IsOpen
Predicate Class IsCompositeChanged
Predicate Class HasName
Predicate Class HasDescription
Predicate Class HasNumber
Predicate Class HasNumberOfObjects
Predicate Class HasNumberOfLeafs
Predicate Class HasLabel
Predicate Class HasClassName
Class License
Stored Properties of Class License
Predicate Class HasUserName
Predicate Class HasCompanyName
Predicate Class HasKey
Predicate Class HasFeatureId
Predicate Class HasDate
Predicate Class HasHostId
Class LicensingManager
Stored Properties of Class LicensingManager
Calculated Properties of Class LicensingManager
Commands of Class LicensingManager
Predicate Class IsLicenseAccepted
Predicate Class IsResult
Predicate Class HasRequestorName
Predicate Class HasCompany
Predicate Class HasEMail
Predicate Class HasCurrentDate
Predicate Class HasCurrentFeatureId
Predicate Class HasCurrentHostId
Predicate Class HasFaultString
Container Class std_vector_Object
4. Package core
Container Class std_vector_AtomComposite
Container Class std_vector_Composite
Container Class std_vector_Bond
Container Class std_vector_Atom
Container Class std_vector_Element
Functions for Atoms
Class Amino
Stored Properties of Class Amino
Predicate Class HasSymbol
Predicate Class HasAminoName
Predicate Class HasColor
Class Aminos
Class ARGEdit
Class Array
Stored Properties of Class Array
Predicate Class IsBoundingBoxVisible
Class Atom
Stored Properties of Class Atom
Calculated Properties of Class Atom
Predicate Class IsInRing
Predicate Class IsHydrogen
Predicate Class IsOxygen
Predicate Class IsCarbon
Predicate Class IsCarbonAlpha
Predicate Class IsNitrogen
Predicate Class IsSulfur
Predicate Class IsPhosphorus
Predicate Class IsBoron
Predicate Class IsIodine
Predicate Class IsBromine
Predicate Class IsChlorine
Predicate Class IsFluorine
Predicate Class IsAromatic
Predicate Class HasRadius
Predicate Class HasExtId
Predicate Class HasTypeId
Predicate Class HasIndex
Predicate Class HasImplicitHCount
Predicate Class HasTotalHCount
Predicate Class HasValence
Predicate Class HasgetConnectivity
Predicate Class HasgetDegree
Predicate Class HasIsotope
Predicate Class HasFormalCharge
Predicate Class HasHybridization
Predicate Class HasChirality
Predicate Class HasR0
Predicate Class HasNMesh
Predicate Class HasOccupancy
Predicate Class HasPositionX
Predicate Class HasPositionY
Predicate Class HasPositionZ
Predicate Class HasAmino
Predicate Class HascountBonds
Class AtomComposite
Stored Properties of Class AtomComposite
Calculated Properties of Class AtomComposite
Commands of Class AtomComposite
Predicate Class IsNameFlag
Predicate Class IsTypeFlag
Predicate Class IsElementFlag
Predicate Class IsIdFlag
Predicate Class IsRadiusFlag
Predicate Class IsBlink
Predicate Class HasAtomCompositeStickSize
Predicate Class HasBallSize
Predicate Class HasTitle
Predicate Class HasCPKScale
Predicate Class HasSelectionRadius
Predicate Class HasSelectionName
Predicate Class HasSelectionElement
Predicate Class HasSelectionType
Predicate Class HasSelectionId
Predicate Class HasSpeed
Predicate Class HasAtomDisplayStyle
Predicate Class HasReaderAllFileFilter
Predicate Class HasNumberOfAtoms
Predicate Class HasnSelection
Class AtomComponent
Stored Properties of Class AtomComponent
Calculated Properties of Class AtomComponent
Predicate Class HasRed
Predicate Class HasGreen
Predicate Class HasBlue
Predicate Class HasAnnotationMode
Predicate Class HasColorMode
Predicate Class HasCharge
Class BandStructureCalculation
Class Bond
Stored Properties of Class Bond
Predicate Class HasStickSize
Predicate Class HasOrder
Class Chain
Stored Properties of Class Chain
Commands of Class Chain
Predicate Class HasProteinDisplayStyle
Predicate Class HasProteinColorMode
Predicate Class HasProteinAnnotationMode
Class Composite
Stored Properties of Class Composite
Calculated Properties of Class Composite
Commands of Class Composite
Predicate Class HascreateSmilesString
Predicate Class HascountAtoms
Predicate Class HascountBonds
Predicate Class HasHelixRadius
Predicate Class HasFrom
Predicate Class HasTo
Class DNARNA
Class Element
Stored Properties of Class Element
Predicate Class HasElementSymbol
Predicate Class HasElementName
Predicate Class HasConfiguration
Predicate Class HasElementColor
Predicate Class HasZ
Predicate Class HasRow
Predicate Class HasColumn
Predicate Class HasMaxBond
Predicate Class HasCovRadius
Predicate Class HasVDWRadius
Predicate Class HasBSRadius
Predicate Class HasMass
Class Elements
Stored Properties of Class Elements
Class Fragment
Class Frame
Class Group
Commands of Class Group
Class Molecule
Class MolecularEnsemble
Class Nucleotide
Class ObjectComposite
Class PredicateGraph
Class PredicateGraphEdit
Class Protein
Class Residue
Stored Properties of Class Residue
Predicate Class HasSecondaryStructureType
Class Selectable
Stored Properties of Class Selectable
Commands of Class Selectable
Predicate Class IsSelected
Class StaticAtom
Stored Properties of Class StaticAtom
Class System
Class UnknownAmino
Class UnknownElement
Functions for creating Graphs
Functions for creating PredicateGraphs
Functions for Graphs and PredicateGraphs
Function to get Aminos
Function to get Elements
Class Graph
Class GraphEdit
5. Package processor
Class AddHydrogensProcessor
Class AssignBondOrderProcessor
Class AssignIndexProcessor
Class AssignInRingProcessor
Class AssignRadiusProcessor
Class AssignTypeProcessor
Class BaseProcessor
Class BuildBondsProcessor
Class BuildCompositesProcessor
Class BuildRingsProcessor
Class MCSProcessor
Class RMSDeviationProcessor
Class RotationProcessor
Class TranslationProcessor
6. Package predicate
Class MatchPredicate
Class RMSDeviationPredicate
Class SmartsPredicate
Class SmilesPredicate
7. Package io
Function for creating a System from a file
Function for creating a System from a SMILES string
Function for creating a PredicateGraph
Class FileTypeToDescription
Class FileIORegistry
Class StructureReaderRegistry
Class WriterRegistry
Class ExtToFileType
Function for creating a ExtToFileType
Function for creating a FileTypeToDescription
Function for creating a StructureReaderRegistry
Function for creating a WriterRegistry
8. Package component
Class Application
Stored Properties of Class Application
Calculated Properties of Class Application
Commands of Class Application
Predicate Class IsCheckBonds
Predicate Class IsBuildBonds
Predicate Class IsAssignTypes
Predicate Class IsVisibleBonds
Predicate Class IsNotifing
Predicate Class Ischeck
Predicate Class IsLicenseAccepted
Predicate Class IsexistFile
Predicate Class IsemptyClipboard
Predicate Class HasReaderAllFileFilter
Predicate Class HasPreamble
Predicate Class HasWriterAllFileFilter
Predicate Class HasRNADNADisplayStyle
Predicate Class HasAtomDisplayStyle
Predicate Class HasProteinDisplayStyle
Predicate Class HasAnnotationMode
Predicate Class HasN
Predicate Class HasApplicationName
Predicate Class HasVersion
Predicate Class HasBuildNumber
Predicate Class HasFileName
Predicate Class Hasdownload
Predicate Class HasnModel
Class AtomDisplayStyle
Stored Properties of Class AtomDisplayStyle
Predicate Class IsDisplayBondOrder
Predicate Class HasStickSize
Predicate Class HasBallSize
Predicate Class HasCPKScale
Predicate Class HasColorMode
Class Basis
Class ComponentInterface
Class Component
Class Data
Calculated Properties of Class Data
Predicate Class HasReaderAllFileFilter
Class Model
Stored Properties of Class Model
Calculated Properties of Class Model
Commands of Class Model
Predicate Class IsCameraInitialized
Predicate Class IsVisibleBonds
Predicate Class IsemptySelection
Predicate Class HasRadians
Predicate Class HasnSelection
Class Monitors
Stored Properties of Class Monitors
Predicate Class HasCurrentTarget
Class GroupOfAtoms
Stored Properties of Class GroupOfAtoms
Commands of Class GroupOfAtoms
Predicate Class IsColorLegend
Predicate Class IsDisableAcceleration
Predicate Class IsAddAndUpdateHydrogens
Predicate Class IsAutomaticallyCleanMolecules
Predicate Class IsCleanSelectedAtoms
Predicate Class IsDepthCue
Predicate Class IsFastRender
Predicate Class IsUsePDBSecondary
Predicate Class IsPerceiveAromaticity
Predicate Class IsDisplayUnitCell
Predicate Class IsCreateAnimation
Predicate Class IsConvertTo3D
Predicate Class IsAddHydrogens
Predicate Class IsUseAtomChargesFromFile
Predicate Class IsStereo
Predicate Class IsHeadLight
Predicate Class IsLight1
Predicate Class IsLight2
Predicate Class IsIncludeIntermolecularForces
Predicate Class IsPerceiveAndUpdateAromaticity
Predicate Class HasPositiveColorRed
Predicate Class HasPositiveColorGreen
Predicate Class HasPositiveColorBlue
Predicate Class HasNeutralColorRed
Predicate Class HasNeutralColorGreen
Predicate Class HasNeutralColorBlue
Predicate Class HasNegativeColorRed
Predicate Class HasNegativeColorGreen
Predicate Class HasNegativeColorBlue
Predicate Class HasLighting1ColorRed
Predicate Class HasLighting1ColorGreen
Predicate Class HasLighting1ColorBlue
Predicate Class HasLighting2ColorRed
Predicate Class HasLighting2ColorGreen
Predicate Class HasLighting2ColorBlue
Predicate Class HasBackgroundColorRed
Predicate Class HasBackgroundColorGreen
Predicate Class HasBackgroundColorBlue
Predicate Class HasLighting1DirectionX
Predicate Class HasLighting1DirectionY
Predicate Class HasLighting1DirectionZ
Predicate Class HasLighting2DirectionX
Predicate Class HasLighting2DirectionY
Predicate Class HasLighting2DirectionZ
Predicate Class HasStereoOffset
Predicate Class HasPerspectiveAngle
Predicate Class HasLineWidth
Predicate Class HasGraphicsQuality
Predicate Class HasPrintQuality
Predicate Class HasPickTolerance
Predicate Class HasViewSize
Predicate Class HasRotateMode
Predicate Class HasSelectMode
Predicate Class HasProjectionMode
Predicate Class HasEyesMode
Class Groups
Stored Properties of Class Groups
Commands of Class Groups
Class Simulation
Stored Properties of Class Simulation
Commands of Class Simulation
Predicate Class HasDistance
Predicate Class HasIter
Predicate Class HasEpsilon
Predicate Class HasNMax
Predicate Class HasStatus
Class SpaceGroup
Stored Properties of Class SpaceGroup
Calculated Properties of Class SpaceGroup
Predicate Class HasA
Predicate Class HasB
Predicate Class HasC
Predicate Class HasAlpha
Predicate Class HasBeta
Predicate Class HasGamma
Predicate Class HasSpaceGroupName
Predicate Class HasSpaceGroupNumber
Predicate Class HasGenerator
Predicate Class HasSpaceGroupId
Predicate Class HasCrystalFamilyName
Predicate Class HasCrystalSystemName
Predicate Class HasSpaceGroupString
Predicate Class HasPointGroupString
Predicate Class HasBravaisSystemNumber
Predicate Class HasBravaisLatticeNumber
Predicate Class HasV
Class Selection
Stored Properties of Class Selection
Commands of Class Selection
Class Parameter

Copyright © 2006 NanoTech Software GmbH. All rights reserved.