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User Guides - Graphical visualisers & modellers on the NSCCS cluster
Maestro
Maestro is the graphical interface for use with the software packages Jaguar and MacroModel. Maestro has a builder for building the structure and setting up Jaguar and MacroModel input files. It also has a range of functionalities for visualising and analysing results.
Maestro is available on Magellan, and can be accessed by using the runscript $CHEM/runmaestro91. For more details, please read the man page by typing: man runmaestro91. Please note that users should not submit their jobs directly via Maestro, all jobs should be submitted via the LSF batch queues.
Documention for Maestro can be found in the Maestro User Guide. It is available as a PDF file in $CHEM/doc/jaguar/maestro.
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