BALL::Kekuliser::AtomInfo Struct Reference

Public Member Functions
bool	operator< (const AtomInfo &info) const
AtomInfo &	operator= (const AtomInfo &ai)

Public Attributes
Atom *	atom
Bond *	double_bond
std::vector< Bond * >	abonds
std::vector< Position >	partner_id
Index	curr_double
Index	min_double
Index	max_double
Index	uncharged_double

Detailed Description

Definition at line 40 of file kekulizer.h.

Member Function Documentation

bool BALL::Kekuliser::AtomInfo::operator<

(

const AtomInfo &

info

)

const

AtomInfo& BALL::Kekuliser::AtomInfo::operator=

(

const AtomInfo &

ai

)

Member Data Documentation

std::vector<Bond*> BALL::Kekuliser::AtomInfo::abonds

Definition at line 53 of file kekulizer.h.

Atom* BALL::Kekuliser::AtomInfo::atom

Definition at line 47 of file kekulizer.h.

Index BALL::Kekuliser::AtomInfo::curr_double

Definition at line 59 of file kekulizer.h.

Bond* BALL::Kekuliser::AtomInfo::double_bond

Definition at line 50 of file kekulizer.h.

Index BALL::Kekuliser::AtomInfo::max_double

Definition at line 65 of file kekulizer.h.

Index BALL::Kekuliser::AtomInfo::min_double

Definition at line 62 of file kekulizer.h.

std::vector<Position> BALL::Kekuliser::AtomInfo::partner_id

Definition at line 56 of file kekulizer.h.

Index BALL::Kekuliser::AtomInfo::uncharged_double

Definition at line 68 of file kekulizer.h.