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Geometric
approach for screening of molecular caging complexes:
(a) iterating through a pool of host and guest candidates; (b) selecting
conformations for the analysis; (c) representing conformations as
rigid bodies composed of balls; (d) analyzing the free space of the
guest object. Here, SO(3) is the space of possible
orientations, and 
corresponds to different
positions in the
Euclidean space.
