schrodinger.application.jaguar.gui.tabs.irc_tab module¶
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class
schrodinger.application.jaguar.gui.tabs.irc_tab.
IrcTab
(parent, input_selector=None)¶ Bases:
schrodinger.application.jaguar.gui.tabs.multi_structure_tab.MultiStructureTab
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NAME
= 'IRC'¶
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HELP_TOPIC
= 'JAGUAR_TOPIC_IRC_FOLDER'¶
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UI_MODULES
= (<module 'schrodinger.application.jaguar.gui.ui.irc_top_ui' from '/scr/buildbot/savedbuilds/2018-2/NB/build-169/internal/lib/python3.6/site-packages/schrodinger/application/jaguar/gui/ui/irc_top_ui.py'>, <module 'schrodinger.application.jaguar.gui.ui.multi_structures_ui' from '/scr/buildbot/savedbuilds/2018-2/NB/build-169/internal/lib/python3.6/site-packages/schrodinger/application/jaguar/gui/ui/multi_structures_ui.py'>, <module 'schrodinger.application.jaguar.gui.ui.irc_bottom_ui' from '/scr/buildbot/savedbuilds/2018-2/NB/build-169/internal/lib/python3.6/site-packages/schrodinger/application/jaguar/gui/ui/irc_bottom_ui.py'>, (<class 'schrodinger.application.jaguar.gui.tabs.molecule_tab.MoleculeTabNoInputSelector'>, 'molecule_sub_tab'))¶
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DIRECTIONS
= {'Downhill': 'downhill', 'Forward': 'forward', 'Forward/Reverse': 'both', 'Reverse': 'reverse'}¶
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setup
()¶ Perform tab specific initialization. This function should be defined in subclasses if initialization is needed.
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directionChanged
()¶ Respond to the direction combo box selection changing
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getDefaultKeywords
()¶ Get the default keywords for this tab. Note that defaults that exist in mmjag should not be explicitly set here.
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getMmJagKeywords
()¶ Return all keywords that should be put into the mmjag handle. This function should be defined in subclasses.
Returns: All keywords that should be put into the mmjag handle Return type: dict Raises: schrodinger.application.jaguar.gui.utils.JaguarSettingError – If any settings are invalid.
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loadSettings
(jag_input)¶ Restore tab settings from mmjag keywords. This function should be defined in subclasses.
Parameters: jag_input ( schrodinger.application.jaguar.input.JaguarInput
) – The Jaguar settings to base the tab settings on
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