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sortDOCKout
Daniel Gschwend
Sorts DOCK output of any kind (either SINGLE or SEARCH from any scoring
option) by contact score, force-field score, rms deviation, or compound
registry number, depending on what's in the input. Either a specified number
of structures may be sorted and extracted, or a window around a particular
parameter (e.g. 5 kcal/mol above lowest force-field score, 2.0 Å
above lowest rms deviation, 50 below the best contact score, etc.).
Bugs??
Curator: Daniel Gschwend, gschwend@cgl.ucsf.edu (rev. 1 September 1995)