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Which library should I use for virtual screening?
Up to table of contentsThis FAQ applies to: AutoDock 3, AutoDock 4
There are a variety of libraries that can be used for screening, which one should I use?
If you want to try and find novel compounds, you probably want to use a library designed for diversity, one which probes a large chemical space. If there are small molecules which are known to bind to your macromolecule, you may want to construct a tailored library of related compounds.