gemmi::Restraints::Chirality Struct Reference

#include <chemcomp.hpp>

Public Member Functions
bool	is_wrong (double volume) const
std::string	str () const

Static Public Member Functions
static const char *	what ()

Public Attributes
AtomId	id_ctr
AtomId	id1
AtomId	id2
AtomId	id3
ChiralityType	sign

Detailed Description

Definition at line 117 of file chemcomp.hpp.

Member Function Documentation

what()

static const char * gemmi::Restraints::Chirality::what ( )

inlinestatic

Definition at line 118 of file chemcomp.hpp.

is_wrong()

bool gemmi::Restraints::Chirality::is_wrong ( double  volume ) const

inline

Definition at line 122 of file chemcomp.hpp.

str()

std::string gemmi::Restraints::Chirality::str ( ) const

inline

Definition at line 126 of file chemcomp.hpp.

Member Data Documentation

id_ctr

AtomId gemmi::Restraints::Chirality::id_ctr

Definition at line 119 of file chemcomp.hpp.

id1

AtomId gemmi::Restraints::Chirality::id1

Definition at line 119 of file chemcomp.hpp.

id2

AtomId gemmi::Restraints::Chirality::id2

Definition at line 119 of file chemcomp.hpp.

id3

AtomId gemmi::Restraints::Chirality::id3

Definition at line 119 of file chemcomp.hpp.

sign

ChiralityType gemmi::Restraints::Chirality::sign

Definition at line 120 of file chemcomp.hpp.

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

• /home/wojdyr/gemmi/gemmi/include/gemmi/chemcomp.hpp