Module pairwise

Module pairwise 

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Pairwise interactions.

Modules§

angular_mask
AngularMask and related data structures.

Structs§

AngularMask
Evaluate an isotropic pairwise energy masked by angular patches (not differentiable).
Anisotropic
Compute anisotropic properties from a pair of sites.
ApproximateShapeOverlap
Apply an isotropic potential evaluated at the approximate signed overlap distance.
HardShape
Infinite energy when sites overlap, 0 when they don’t (not differentiable).
HardSphere
Model infinitely hard spheres when used with PairwiseCutoff (not differentiable).
Isotropic
Compute isotropic interactions between a pair of sites.

Traits§

AnisotropicEnergy
Computes pairwise energies between oriented particles.