CrossDocker: a tool for performing cross-docking using Autodock Vina.

ABSTRACT: BACKGROUND:Cross-docking is an approach to find the best holo structures among multiple structures available for a target protein. RESULTS:CrossDocker significantly decreases the time needed for setting parameters and inputs for performing multiple dockings, data collection and subsequent analysis. CONCLUSION:CrossDocker was written in Python language and is available as executable binary for Windows operating system. It is available at http://www.pharm-sbg.com. Some example data sets were also provided.

SUBMITTER: Shamsara J 

PROVIDER: S-EPMC4797978 | biostudies-literature | 2016

REPOSITORIES: biostudies-literature