Package schrodinger :: Package application :: Package qsite :: Module input
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Module input

Module for reading and writing QSite input files.

See QSiteInput class for more documentation.

Copyright Schrodinger, LLC. All rights reserved.

Classes [hide private]
  Cut
A class to handle representation and printing of general qm region cuts.
  HydrogenCap
A class to handle representation and printing of hydrogen caps for the qm region.
  _GenDict
A dictionary-like class for getting and setting keywords in the &gen section of qsite input, which controls the Jaguar portion of the calculation.
  _MopacDict
A dictionary-like class for getting and setting keywords in the &mopac section of qsite input, which controls the Jaguar/MOPAC portion of the calculation.
  QMRegion
A class to provide access to a &qmregion specification and the ability to create one on the fly.
  QSiteInput
Variables [hide private]
  _qmregion_int_default = -9999
  _qmregion_str_default = ''
  QM = 'qm'
  NDDO = 'nddo'
  __package__ = 'schrodinger.application.qsite'