Uses of Interface
ffx.potential.nonbonded.MaskingInterface
Packages that use MaskingInterface
Package
Description
The Nonbonded package implements nonbonded molecular mechanics terms such as van der Waals and
Particle Mesh Ewald electrostastics.
The pme package implements polarization and permanent electrostatics using
Particle Mesh Ewald (PME).
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Uses of MaskingInterface in ffx.potential.nonbonded
Classes in ffx.potential.nonbonded that implement MaskingInterfaceModifier and TypeClassDescriptionclassThe Van der Waals class computes Van der Waals interaction in parallel using aNeighborListfor anyCrystal.classThe Van der Waals class computes Van der Waals interaction in parallel using aNeighborListfor P1 (no symmetry)Crystalsystems. -
Uses of MaskingInterface in ffx.potential.nonbonded.pme
Classes in ffx.potential.nonbonded.pme that implement MaskingInterfaceModifier and TypeClassDescriptionclassParallel computation of the permanent field.classParallel evaluation of the PME real space energy and gradient.