As we all know, docking is screening a wide range of ligands on a specific receptor with defined binding site.
May I know any protocol/tool in Discovery Studio that could do screening on a ligand against a wide range of receptors at a single go?
If has, kindly let me know. Would very much appreciate your sharing.
It is possible to do an ensemble docking using GOLD. Here, aligned multiple proteins (up to 20 or so) can be used for docking.
But remember the proteins need to be aligned.
Hope that helps
Thank you Jurgen
I will look for GOLD (as currently I dont have that) and to see any possible way to implement it.
Thank you for your kind suggestion!