#include <linkhunt.hpp>

Public Member Functions
void	index_chem_links (const MonLib &monlib, bool use_alias=true)

std::vector< Match >	find_possible_links (Structure &st, double bond_margin, double radius_margin, ContactSearch::Ignore ignore)

Public Attributes
double	global_max_dist = 2.34

const MonLib *	monlib_ptr = nullptr

std::multimap< std::string, const ChemLink * >	links

Detailed Description

Definition at line 17 of file linkhunt.hpp.

Member Function Documentation

void gemmi::LinkHunt::index_chem_links	(	const MonLib &	monlib,
		bool	use_alias = `true`
	)

inline

Definition at line 33 of file linkhunt.hpp.

std::vector< Match > gemmi::LinkHunt::find_possible_links	(	Structure &	st,
		double	bond_margin,
		double	radius_margin,
		ContactSearch::Ignore	ignore
	)

inline

Definition at line 92 of file linkhunt.hpp.

double gemmi::LinkHunt::global_max_dist = 2.34

Definition at line 29 of file linkhunt.hpp.

const MonLib* gemmi::LinkHunt::monlib_ptr = nullptr

Definition at line 30 of file linkhunt.hpp.

std::multimap<std::string, const ChemLink*> gemmi::LinkHunt::links

Definition at line 31 of file linkhunt.hpp.

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