OpenStructure
Public Member Functions
Checker Class Reference

#include <model_check.hh>

Public Member Functions

 Checker (CompoundLibPtr lib, const mol::EntityHandle &ent, Diagnostics &diags)
 
void CheckForUnknownAtoms ()
 
void CheckForCompleteness (bool require_hydrogens=false)
 
void CheckForNonStandard ()
 
mol::AtomHandleList GetHydrogens ()
 
mol::AtomHandleList GetZeroOccupancy ()
 

Detailed Description

Definition at line 9 of file model_check.hh.

Constructor & Destructor Documentation

◆ Checker()

Checker ( CompoundLibPtr  lib,
const mol::EntityHandle ent,
Diagnostics diags 
)
inline

Definition at line 11 of file model_check.hh.

Member Function Documentation

◆ CheckForCompleteness()

void CheckForCompleteness ( bool  require_hydrogens = false)

◆ CheckForNonStandard()

void CheckForNonStandard ( )

◆ CheckForUnknownAtoms()

void CheckForUnknownAtoms ( )

◆ GetHydrogens()

mol::AtomHandleList GetHydrogens ( )

◆ GetZeroOccupancy()

mol::AtomHandleList GetZeroOccupancy ( )

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