#include <gromacs/gmxpreprocess/hackblock.h>

Description

Information about single bonded interaction.

Public Member Functions
const std::string &	ai () const
	Get name of first atom in bonded interaction.

const std::string &	aj () const
	Get name of second atom in bonded interaction..

const std::string &	ak () const
	Get name of third atom in bonded interaction.

const std::string &	al () const
	Get name of fourth atom in bonded interaction.

const std::string &	am () const
	Get name of fifth atom in bonded interaction.

Public Attributes
std::array< std::string, MAXATOMLIST >	a
	Atom names in the bond.

std::string	s
	Optional define string which gets copied from .rtp/.tdb to .top and will be parsed by cpp during grompp.

bool	match = false
	Has the entry been found?

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

Public Member Functions