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Which library should I use for virtual screening?

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This 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.

by Ruth Huey last modified 2007-07-19 17:57
Contributors: Ruth Huey

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