Multiligand docking

[Secomxslw]

Single protein dock with two or more ligands. How to do it?

[Glinttsd]

Hi, you can do virtual screening via indicating a ligand directory (which contains multiple ligands). Examples are here.

[DUTchecheche]

Multiple ligands docking (once time) is a new feature in Vina 1.2.x, while Vina-GPU is developed based on an old version of Vina (1.1.2).