How do I calculate torsions after a conformational analysis of a single compound and write the data into a table?

Go to Tools → Measurements → Dihedral and select "Create property for selected entries" at the bottom of the panel, then pick the torsions you want to write out. Each output torsion for the structures is reported in a column in the Project Table. You can then export this data to a CSV file for use in a spreadsheet with Table → Export → Spreadsheet.

Keywords: torsions, dihedral, create property, Maestro

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