Name:Docking Gateway (AMC)
Description:Gateway for high-performance virtual drug screening with AutoDcok Vina
Abstract:The docking gateway enables users to run AutoDock Vina on the Dutch grid infrastructure.
It provides the following aspects: an easy-to-use interface resembling that of AutoDock Tools, a predefined (and easily extensible upon user request) set of ligand libraries, provenance information for each processing including all the inputs and outputs, and ability to view live report of ongoing experiments. The gateway can also run on multiple platforms (currently also a Hadoop cluster).
The gateway is open for usage based on registration.