OECreateMMPIndexOptions

class OECreateMMPIndexOptions

Encapsulates the properties that control a matched pair indexing analysis.

Constructors

OECreateMMPIndexOptions(mmpopts: OEMatchedPairAnalyzerOptions) -> OECreateMMPIndexOptions

Constructors that initialize an OECreateMMPIndexOptions object. The default constructor provides the following properties:

**Default parameters of OEMatchedPairAnalyzerOptions**
Property	Default value
processor type	`OEMatchedPairProcessor_Default`
options	`OEMatchedPairOptions_Default`
bond fragmentation limit	20
heavy atom filter	100
indexable fragment filter based on min,max heavy atom percentage of the input structure	85-100%

GetMaxRecord

GetMaxRecord() -> int

Return the maximum number of records to index from the input structure file or 0 to indicate all structures should be indexed.

GetMMPOptions

GetMMPOptions() -> OEMatchedPairAnalyzerOptions

Returns the options controlling the Matched Pair indexing information.

GetNumThreads

GetNumThreads() -> int

Returns the number of threads to use during the indexing phase. If the number of threads specified is 0, OEGetNumProcessors will be used to interrogate the maximum threads allowed.

GetVerbose

GetVerbose() -> int

Return the level of output verbosity during the indexing activity.

SetMaxRecord

SetMaxRecord(maxrec: int) -> None

Sets the maximum number of records to index from the input structure file. 0 indicates all structures should be indexed.

SetNumThreads

SetNumThreads(nthreads: int) -> None

Sets the maximum number of threads to use during the indexing phase. If nthreads is set to 0, OEGetNumProcessors will be used to interrogate the maximum threads allowed.

SetTracer

SetTracer(dots: OEDots) -> None

Sets a tracer that can be used to show the progress of indexing.

SetVerbose

SetVerbose(verbose: int) -> None

Sets the level of output verbosity during the indexing activity. 0 (off), 1 (verbose), or 2 (very verbose) are sufficient values for output verbosity.