Hi,
Where can I find the individual Haddock scores of structures within the best cluster?
Thank you
Hi,
Where can I find the individual Haddock scores of structures within the best cluster?
Thank you
For this you will need to download the full tar archive of the run and look into the …/structures/it1/water
directory.
You fill find for each cluster a file listing the members of the cluster with their associated score, e.g. file.nam_clust1_haddock-score
That helped. Thank you, Professor.