apocharmm.atom_reference Namespace Reference

Provides the Python topology-aware atom-reference value type. More...

Classes
class	AtomReference
	Owns one topology-aware zero-based atom identity. More...

Detailed Description

Provides the Python topology-aware atom-reference value type.

AtomReference identifies one zero-based atom index in one native CharmmPsf object. Topology identity is native PSF object identity rather than file-name or file-content equality.

See also

atom_selection