Uses of Class
ffx.numerics.quickhull.QuickHull3D
Packages that use QuickHull3D
Package
Description
The Utils package implements core functionality needed for using the Potential package, such as
opening and closing structure files, basic force field energy evaluations, etc.
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Uses of QuickHull3D in ffx.potential.utils
Methods in ffx.potential.utils that return QuickHull3DModifier and TypeMethodDescriptionstatic QuickHull3DConvexHullOps.constructHull(Atom[] atoms) Constructs a convex hull from a set of atoms.Methods in ffx.potential.utils with parameters of type QuickHull3DModifier and TypeMethodDescriptionstatic Atom[]ConvexHullOps.identifyHullAtoms(QuickHull3D quickHull3D, Atom[] allAtoms) UNTESTED: Identifies atoms forming the convex hull.static doubleConvexHullOps.maxDist(QuickHull3D quickHull3D) Find the maximum pairwise distance between vertex points on a convex hull.