bond_sym_proxy Struct Reference

Grouping of bond_simple_proxy and symmetry operation (rt_mx_ji). More...

#include <bond.h>

Inheritance diagram for bond_sym_proxy:

List of all members.

Public Member Functions
	bond_sym_proxy ()
	Default constructor. Some data members are not initialized!
	bond_sym_proxy (af::tiny< unsigned, 2 > const &i_seqs_, sgtbx::rt_mx const &rt_mx_ji_, double distance_ideal_, double weight_, double slack_=0)
	Constructor.
	bond_sym_proxy (af::tiny< unsigned, 2 > const &i_seqs_, sgtbx::rt_mx const &rt_mx_ji_, bond_params const &params)
	Constructor.
Public Attributes
af::tiny< unsigned, 2 >	i_seqs
	Indices into array of sites.
sgtbx::rt_mx	rt_mx_ji
	Symmetry operation to be applied to i_seqs[1].

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Detailed Description

Grouping of bond_simple_proxy and symmetry operation (rt_mx_ji).

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Constructor & Destructor Documentation

bond_sym_proxy	(	af::tiny< unsigned, 2 > const &	i_seqs_,
		sgtbx::rt_mx const &	rt_mx_ji_,
		bond_params const &	params
	)			[inline]

Constructor.

Not available in Python.

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Member Data Documentation

sgtbx::rt_mx rt_mx_ji

Symmetry operation to be applied to i_seqs[1].

The bond is between sites_frac[i_seqs[0]] and rt_mx_ji * sites_frac[i_seqs[1]].

Referenced by bond::bond().

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

• cctbx/geometry_restraints/bond.h