I recommend including a table that summarizes the statistics of the HADDOCK clusters. You can refer to the example I’ve attached from the article below and use a similar format for your own.

It’s also a good idea to visualize the representative structure of each cluster and highlight the key atomistic interactions. For structure visualization, you can use tools like PyMOL, VMD, Chimera, or Discovery Studio.

For 2D interaction diagrams, tools like LigPlus and PDBsum can help clearly illustrate the binding interactions.

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