#include <molck.hh>

Public Member Functions
	MolckSettings (bool init_rm_unk_atoms=false, bool init_rm_non_std=false, bool init_rm_hyd_atoms=true, bool init_rm_oxt_atoms=false, bool init_rm_zero_occ_atoms=false, bool init_colored=false, bool init_map_nonstd_res=true, bool init_assign_elem=true)

std::string	ToString ()

Data Fields
bool	rm_unk_atoms

bool	rm_non_std

bool	rm_hyd_atoms

bool	rm_oxt_atoms

bool	rm_zero_occ_atoms

bool	colored

bool	map_nonstd_res

bool	assign_elem

Detailed Description

Definition at line 37 of file molck.hh.

Constructor & Destructor Documentation

◆ MolckSettings()

MolckSettings	(	bool	init_rm_unk_atoms = `false`,
		bool	init_rm_non_std = `false`,
		bool	init_rm_hyd_atoms = `true`,
		bool	init_rm_oxt_atoms = `false`,
		bool	init_rm_zero_occ_atoms = `false`,
		bool	init_colored = `false`,
		bool	init_map_nonstd_res = `true`,
		bool	init_assign_elem = `true`
	)

inline

Definition at line 48 of file molck.hh.

Member Function Documentation

◆ ToString()

std::string ToString ( )

inline

Definition at line 66 of file molck.hh.

Field Documentation

◆ assign_elem

bool assign_elem

Definition at line 46 of file molck.hh.

◆ colored

bool colored

Definition at line 44 of file molck.hh.

◆ map_nonstd_res

bool map_nonstd_res

Definition at line 45 of file molck.hh.

◆ rm_hyd_atoms

bool rm_hyd_atoms

Definition at line 41 of file molck.hh.

◆ rm_non_std

bool rm_non_std

Definition at line 40 of file molck.hh.

◆ rm_oxt_atoms

bool rm_oxt_atoms

Definition at line 42 of file molck.hh.

◆ rm_unk_atoms

bool rm_unk_atoms

Definition at line 39 of file molck.hh.

◆ rm_zero_occ_atoms

bool rm_zero_occ_atoms

Definition at line 43 of file molck.hh.

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

build-dev-doc/stage/include/ost/mol/alg/molck.hh

Public Member Functions

Data Fields