Molecular Docking using PyRx and AutoDock/Vina

[@matthewdyer7501]

You have saved my sanity. Thank you very very very much for taking the time to post this. Bless you.

[@AKBIT]

Thank you so much for your lovely feedback. 😊

[@ashmitabiswas9226]

Can you please tell me If I want to do multiple screenings in one go then which will be better? Pyrx or autodock vina? I will do target docking.

[@AKBIT]

Pyrx is a graphical interface to the command-line AutoDock Vina program. So, Pyrx is user friendly to perform multiple screenings without much technical knowledge on AutoDock Vina commands.