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Toolkits--cpp
  • Docs »
  • Omega Toolkit 2.9.0 »
  • OEConfGen Classes
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OEConfGen ClassesΒΆ

  • OEOmega
    • Constructors
    • operator=
    • operator()
    • AddFragLib
    • Build
    • ClearFragLibs
    • GetOptions
    • SetOptions
  • OEOmegaOptions
    • Constructors
    • operator=
    • ClearFixFile
    • GetBuildForceField
    • GetCanonOrder
    • GetCommentEnergy
    • GetDielectric
    • GetEnergyRange
    • GetEnergyWindow
    • GetEnumNitrogen
    • GetEnumRing
    • GetExponent
    • GetFixDeleteH
    • GetFixMaxMatch
    • GetFixMol
    • GetFixRMS
    • GetFixSubSearch
    • GetFixUniqueMatch
    • GetFromCT
    • GetIncludeInput
    • GetMaxConfRange
    • GetMaxConfs
    • GetMaxRotors
    • GetMaxSearchTime
    • GetRMSRange
    • GetRMSThreshold
    • GetRangeIncrement
    • GetRotorOffset
    • GetSampleHydrogens
    • GetSDEnergy
    • GetSearchForceField
    • GetStrictAtomTypes
    • GetStrictStereo
    • GetTorLib
    • GetTorsionDrive
    • GetWarts
    • SetBuildForceField
    • SetCanonOrder
    • SetCommentEnergy
    • SetDielectric
    • SetEnergyRange
    • SetEnergyWindow
    • SetEnumNitrogen
    • SetEnumRing
    • SetExponent
    • SetFixDeleteH
    • SetFixFile
    • SetFixMaxMatch
    • SetFixMol
    • SetFixQuery
    • SetFixRMS
    • SetFixSmarts
    • SetFixUniqueMatch
    • SetFromCT
    • SetIncludeInput
    • SetMaxConfRange
    • SetMaxConfs
    • SetMaxRotors
    • SetMaxSearchTime
    • SetRMSRange
    • SetRMSThreshold
    • SetRangeIncrement
    • SetRotorOffset
    • SetRotorPredicate
    • SetSampleHydrogens
    • SetSDEnergy
    • SetSearchForceField
    • SetStrictAtomTypes
    • SetStrictStereo
    • SetTorLib
    • SetTorsionDrive
    • SetWarts
  • OETorLib
    • Constructors
    • operator bool
    • AddTorsionLibrary
    • AddTorsionRule
    • ClearTorsionLibrary
    • GetTorRule
    • GetTorRules
    • HasTorRule
    • ResetTorsionLibrary
    • SetTorsionLibrary
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© Copyright 2019, OpenEye Scientific Software, Inc. Last updated on May 01, 2019.