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object --+ | MopacLauncher --+ | MopacLauncher71
This is the API for executing the MOPAC7.1 backend compiled from source, where we link to a shared library.
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MopacResults object |
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_default_method = 'MNDO'
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_valid_methods = ['AM1', 'MNDO', 'MNDOD', 'PM3', 'RM1']
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_method_synonyms = {'MNDO-D': 'MNDOD', 'MNDO/D': 'MNDOD'}
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Inherited from |
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x.__init__(...) initializes x; see help(type(x)) for signature
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This is not needed for MOPAC7.1. Plotting is requested through MOPAC keywords.
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Run a MOPAC calculation in the local directory. The optional Structure object is updated with the output data. Return a MopacResults object.
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