OpenMM
Atom Class Reference

An Atom object represents a residue within a Topology. More...

List of all members.

Public Member Functions

def __init__
 Construct a new Atom.
def __repr__

Public Attributes

 name
 The name of the Atom.
 element
 That Atom's element.
 index
 The index of the Atom within its Topology.
 residue
 The Residue this Atom belongs to.
 id
 A user defined identifier for this Atom.

Detailed Description

An Atom object represents a residue within a Topology.


Constructor & Destructor Documentation

def __init__ (   self,
  name,
  element,
  index,
  residue,
  id 
)

Construct a new Atom.

You should call addAtom() on the Topology instead of calling this directly.


Member Function Documentation

def __repr__ (   self)

Member Data Documentation

That Atom's element.

id

A user defined identifier for this Atom.

The index of the Atom within its Topology.

The name of the Atom.

The Residue this Atom belongs to.


The documentation for this class was generated from the following file:
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