AutoDock Vina

A molecular docking and virtual screening program

AutoDock Vina is an open-source program for doing molecular docking.

It was designed and implemented by Dr. Oleg Trott in the Molecular Graphics Lab at The Scripps Research Institute.

Access policy

AutoDock Vina can be accessed via the EGI Applications on Demand Platform.

ClustalW2 & EGI

AutoDock Vina uses Cloud Compute resources offered by several EGI cloud providers: BIFI (Spain), CESGA (Spain), RECAS-BARI (Italy).

Reference

Trott et al. 2010. AutoDock Vina: improving the speed and accuracy of docking with a new scoring function, efficient optimization and multithreading. Doi: 10.1002/jcc.21334 (full text, open source)