Package schrodinger :: Package pipeline :: Package stages :: Module pull
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Module pull

A stage for extracting a subset of ligands/compounds.

The Pull stage identifies a subset of compounds from one set of ligand structures, and extracts all variants of those compounds from a second set of ligand structures.

Copyright Schrodinger, LLC. All rights reserved.

Classes [hide private]
  PullStage
Stage for extracting a subset of ligands/compounds (and their variants) from a second set of ligand files, given the number or percent to keep from a first set of ligand files.
Functions [hide private]
 
_get_reader(filename, astext=False)
Returns a MaestroTextReader instance if specified file is a Maestro file; returns a StructureReader instance otherwize.
Variables [hide private]
  __doc__ = ...
  _version = '$Revision: 1.33 $'
  __package__ = 'schrodinger.pipeline.stages'
Function Details [hide private]

_get_reader(filename, astext=False)

 

Returns a MaestroTextReader instance if specified file is a Maestro file; returns a StructureReader instance otherwize. Ev:61545


Variables Details [hide private]

__doc__

Value:
"""
A stage for extracting a subset of ligands/compounds.

The Pull stage identifies a subset of compounds from one set of ligand
structures, and extracts all variants of those compounds from a second\
 set of
ligand structures.

...