Frequently Asked Questions

Here you can find answers to some of the most frequently asked questions about using MoleCuilder's various interfaces. If you have a question not answered on this page, you can ask it on the MailingList or via email.

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1. Command Line
   1. Output Files
      1. I need the output in format <specific-format>!

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Command Line

Output Files

I need the output in format <specific-format>!

Remember that molecuilder always operates on an output file given by the --input command. It does recognize the format (by the suffix) if the file is empty (e.g. newly created). Also, additional output formats may be specified. This is done by --set-output followed by a space-separated list of desired formats, e.g.

 ... --set-output tremolo pcp xyz