schrodinger.application.macromodel.tools module¶
Useful functions for setting up MacroModel jobs.
Copyright Schrodinger, LLC. All rights reserved.
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schrodinger.application.macromodel.tools.
count
(mae_file='')¶ Returns the total number of structures in a Maestro file.
Uses structure.count_structures when possible.
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schrodinger.application.macromodel.tools.
serial_split
(mae_file='')¶ Returns a list of files generated after executing serial_split.
The user must have the utility, or this will fail. The useful bit is the returned list of file names.