The RigidCLL library


RigidInfo Struct Reference

Rigid information. More...

#include <RigidCLL.h>

Data Fields

unsigned int firstAtom
unsigned int lastAtom

Detailed Description

Information stored for each rigid group of atoms.

Definition at line 157 of file RigidCLL.h.

Field Documentation

unsigned int firstAtom

Index of the first atom in the rigid.

Definition at line 158 of file RigidCLL.h.

Referenced by RigidCLL::AddAtom(), RigidCLL::EndRigid(), RigidCLL::Interactions(), and RigidCLL::NewRigid().

unsigned int lastAtom

Index of the first atom of the next rigid, if any.

Definition at line 159 of file RigidCLL.h.

Referenced by RigidCLL::EndRigid().

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