• Toolkit Version 2023.1
    • 2023.1 Highlights
      • OEToolkits 2023.1.1
      • OEToolkits 2023.1.0
      • General Notices
    • Detailed Release Notes 2023.1
      • OEChem TK 3.4.0.1
      • OEChem TK 3.4.0.0
      • OESystem TK 3.3.1
      • OEPlatform TK 3.3.1
      • OEDepict TK 2.5.2
      • OEDocking TK 4.2.1
      • FastROCS TK 2.2.4
      • Grapheme TK 1.4.7
      • GraphSim TK 2.5.6
      • Lexichem TK 2.8.1
      • OEMedChem TK 1.2.0
      • MolProp TK 2.6.2
      • OEFF TK 2.5.2.1
      • OEFF TK 2.5.2.0
      • Omega TK 4.2.2
      • Quacpac TK 2.2.2
      • Shape TK 3.6.0
      • Sitehopper TK 2.0.3
      • Spicoli TK 1.5.6
      • Spruce TK 1.5.2
      • Szmap TK 1.6.6
      • Szybki TK 2.6.0.1
      • Szybki TK 2.6.0.0
      • Zap TK 2.4.5
    • Recent Release History
      • Release Highlights 2022.2
      • Release Highlights 2022.1
      • Release Highlights 2021.2
    • Previous Release History
      • Release Highlights 2021.1
      • Release Highlights 2020.2
      • Release Highlights 2020.1
      • OEToolkits 2019.Oct
      • OEToolkits 2019.Apr
      • OEToolkits 2018.Oct
      • OEToolkits 2018.Feb
      • OEToolkits 2017.Oct
      • OEToolkits 2017.Jun
      • OEToolkits 2017.Feb
      • OEToolkits 2016.Oct
      • OEToolkits 2016.Jun
      • OEToolkits 2016.Feb
      • OEToolkits 2015.Oct
      • OEToolkits 2015.Jun
      • OEToolkits 2015.Feb
      • OEToolkits 2014.Oct
      • OEToolkits 2014.Jun
      • OEToolkits 2014.Feb
      • OEToolkits 2013.Oct
      • OEToolkits 2013.Jun
      • OEToolkits 2013.Feb
      • OEToolkits 2012.Oct
      • OEToolkits 2012.Jun
      • OEToolkits 2012.Feb
      • OEToolkits 2011.Oct
      • OEToolkits 2011.1
      • OEToolkits 1.7.4
      • OEToolkits 1.7.2
      • OEToolkits 1.7.1
      • OEToolkits 1.7.0
  • Introduction
    • Toolkit API
    • Release Cycle
  • Getting Started with OpenEye Java
    • License for OpenEye Toolkits
    • Introduction
    • Prerequisites
      • Platform Support
      • Windows
      • Linux
      • macOS
    • GPU Prerequisites
    • GPU-Related Requirements
      • Supported Platforms
      • Supported GPUs
      • NVIDIA Drivers
      • Performance Tuning
    • Download the OpenEye Java distribution
    • Installation
    • Using Apache Maven with OpenEye
      • Requirements
      • Creating a Maven Project
      • Using OpenEye Artifacts
      • Finding Available OpenEye Versions
      • Using OpenEye in HelloMaven
      • Using Maven to Compile and Run
      • Thoughts
      • Conclusion
    • How to Develop with the OpenEye Java Toolkit in Eclipse
      • Creating a New Project
      • Adding a Class to Our Project
      • Running Our Example inside Eclipse
      • Creating an Executable JAR
    • Creating an Example on the command line
    • Creating a custom oejava jar file
      • Examples of creating a special jar
    • How to import the toolkits
    • Legal Notices
      • Copyright and Trademarks
      • Sample Code
      • Citation
      • Technology Licensing
  • Informatics and Modeling Toolkits
    • OEChem TK
      • Introduction
      • Theory
      • Examples
      • API
      • Release History
    • OEDepict TK
      • Introduction
      • Theory
      • Examples
      • API
      • Appendices
      • Release History
    • OEDocking TK
      • Introduction
      • Theory
      • OEDocking Examples
      • OEModels Examples
      • API
      • Release History
    • FastROCS™ TK
      • Introduction
      • FastROCS vs ROCS
      • Installation
      • FastROCS Architecture
      • Examples
      • Tutorials
      • API
      • Release History
    • Grapheme™ TK
      • Introduction
      • Theory
      • Examples
      • Preliminary API
      • API
      • Release History
    • GraphSim TK
      • Introduction
      • Theory
      • GPU Fast Fingerprints
      • Examples
      • API
      • Release History
    • Lexichem TK
      • Theory
      • Examples
      • API
      • Release History
    • OEMedChem TK
      • Introduction
      • Theory
      • Examples
      • API
      • Release History
    • MolProp TK
      • Theory
      • Examples
      • API
      • Release History
    • Omega TK
      • Theory
      • GPU-Omega
      • OMEGA Examples
      • API
      • Release History
    • Quacpac TK
      • Theory
      • Examples
      • API
      • Preliminary API
      • Release History
    • Shape TK
      • Theory
      • Examples
      • API
      • Preliminary API
      • Deprecated API
      • Release History
    • Spicoli TK
      • Theory
      • API
      • Release History
    • Szmap TK
      • Introduction
      • Theory
      • Examples
      • API
      • Release History
    • Szybki TK
      • Theory
      • API
      • Preliminary API
      • Examples: Working with Szybki TK
      • Release History
    • Zap Toolkit
      • Theory and Examples
      • API
      • Release History
  • Glossary
  • Bibliography
Toolkits--java
  • All OpenEye Documentation »
  • Contents »
  • Informatics and Modeling Toolkits »
  • OEChem Toolkit 3.4.0.1 »
  • API »
  • Preliminary OEChem Classes

Preliminary OEChem Classes¶

  • OECreateSubSearchDatabaseOptions
    • Constructors
    • GetKeepTitle
    • GetNumProcessors
    • GetScreenType
    • GetSortByBitCounts
    • SetKeepTitle
    • SetNumProcessors
    • SetSortByBitCounts
  • OEFileStringParameter
    • Constructors
    • operator=
  • OEMCSFuncParameter
    • Constructors
    • operator=
  • OEMolParameter
    • Constructors
    • operator=
    • GetSetting
    • GetValue
    • SetValue
  • OEMolReaderParameter
    • Constructors
    • operator=
  • OEMolWriterParameter
    • Constructors
    • operator=
  • OEOutFileStringParameter
    • Constructors
    • operator=
  • OEPredicateParameter
    • Constructors
    • operator=
    • GetDefault
    • GetSetting
    • GetValue
    • SetDefault
    • SetValue
  • OERefInputAppOptions
    • Constructors
    • operator=
    • GetInFile
    • GetOutFile
    • GetRefFile
    • SetInFile
    • SetOutFile
    • SetRefFile
  • OESimpleAppOptions
    • Constructors
    • operator=
    • GetInFile
    • GetOutFile
    • SetInFile
    • SetOutFile
  • OESubSearchDatabase
    • Constructors
    • GetDatabaseType
    • GetMatchIndices
    • GetMatchTitles
    • GetMolecule
    • GetScreenType
    • GetTitle
    • IsValid
    • NumMatches
    • NumMolecules
    • NumProcessors
    • Open
    • Search
  • OESubSearchQuery
    • Constructors
    • SetFilter
    • GetMaxMatches
    • SetMaxMatches
  • OESubSearchResult
    • Constructors
    • Cancel
    • GetMatchIndices
    • GetSearchStatus
    • IsValid
    • NumMatches
    • NumScreened
    • NumSearched
    • NumTargets
    • NumTotalMatches
  • OESubSearchScreen
    • Constructors
    • operator=
    • GetScreenType
    • IsValid
  • OESubSearchScreenTypeBase
    • GetName
    • GetScreenType
    • GetScreenTypeString
    • GetSize
    • GetVersion
    • GetVersionString
  • OEUnAtomPredParameter
    • Constructors
    • operator=
  • OEUnBondPredParameter
    • Constructors
    • operator=
  • OEMolRecord
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