schrodinger.application.jaguar.gui.tabs.input_sub_tabs.basis_set module¶
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class
schrodinger.application.jaguar.gui.tabs.input_sub_tabs.basis_set.BasisSetSubTab(parent=None)¶ Bases:
schrodinger.application.jaguar.gui.tabs.input_sub_tabs.base_sub_tab.BaseSubTabAn Input tab sub-tab for per-atom basis sets
See parent class for documentation on the class variables
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NAME= 'Per-Atom Basis'¶
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PROXY_MODEL_CLASS¶ alias of
BasisSetProxyModel
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TABLE_MODEL_CLASS¶ alias of
BasisSetModel
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UI_MODULE= <module 'schrodinger.application.jaguar.gui.ui.input_sub_tabs.basis_set_ui' from '/scr/buildbot/savedbuilds/2017-4/NB/build-152/internal/lib/python2.7/site-packages/schrodinger/application/jaguar/gui/ui/input_sub_tabs/basis_set_ui.pyc'>¶
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activate()¶
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atomPicked(ws_atom_num)¶ Respond to the user picking a workspace atom
Parameters: ws_atom_num (int) – The atom number of the selected atom in the workspace structure
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deactivate()¶
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loadSettings(jag_input, eid, title, struc)¶
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perAtomBasisSetsPresent()¶ Have any per-atom basis sets been set?
Returns: True if there are per-atom basis sets for any currently selected structures. False otherwise. Return type: bool
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saveSettings(jag_input, eid)¶
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setup()¶
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validate()¶
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