apoCHARMM 1.0.0
High-performance molecular dynamics simulations on GPUs
 
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apocharmm.atom_selector Namespace Reference

Provides the Python atom-selection evaluator. More...

Classes

class  AtomSelector
 Evaluates atom-selection expressions against one native PSF. More...
 

Detailed Description

Provides the Python atom-selection evaluator.

AtomSelector evaluates CHARMM-style selection strings against one CharmmPsf and returns independently owned AtomSelection objects.

See also
atom_selection