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Detailed documentation

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Table of Contents

• Graphical User Interface   -   a detailed documentation on the GUI and the important windows of SA2
• Import workflow   -   the detailed workflow of the import prodecure.
• HTS Flags   -   description of the HTS flags available in SA2 (PAINS, reactive...)
• Properties in SA2   -   how SA2 associate properties to each molecules; how to store your own properties
• Searching molecules   -   similarity search, substructure search...
• Plotting molecules   -   use the XY 2D plot to get an interactive vizualisation of your molecules
• Graph similarity view   -   another way to represent small sets of molecules, under the form of a similarity graph
• Diversity   -   compute diverse subsets, evaluate the diversity of a library...
• Scaffolds and frameworks   -   generalities, generate scaffold report...
• Statistics, reporting   -   do some statistics in your database: compare property distributions, generate reports...
• Workers   -   additional operations that can be performed when importing new molecules

Go To Table of Contents

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