I am using a virtual screening workflow to dock multiple datasets to a grid that I have already created. Although, using the workflow, and the different glide nodes, I don’t seem to be getting the docking score for all ligands in the dataset, I only get a few at the top, and the rest show up as empty. I was wondering if there was a way for all the docking scores to show up?
Hi there @bashok,
welcome to KNIME Community!
Seems this topics belongs to a specific sub-category but not sure which one. There should get proper attention. Which nodes/extension so you use?
I will try posting this in a specific category! Also i am using the Glide Ligand Docking nodes, and am using the settings for Glide HTVS,SP and XP.
no need to post again. I’ll change Category. Hopefully to the right one
Fell free to link workflow you are using.