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vtf_data Struct Reference

List of all members.

Public Attributes
VTFFILE	file
int	return_code
int	read_mode
int	natoms
molfile_atom_t *	atoms
int	optflags
int	nbonds
int *	from
int *	to
unsigned int	timestep
int	timestep_mode
float	A
float	B
float	C
float	alpha
float	beta
float	gamma
float *	coords

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Member Data Documentation

float vtf_data::A

Definition at line 96 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_pbc, and vtf_read_next_timestep.

float vtf_data::alpha

Definition at line 96 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_pbc, and vtf_read_next_timestep.

molfile_atom_t* vtf_data::atoms

Definition at line 83 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_create_atoms_as_needed, vtf_parse_structure, and vtf_read_structure.

float vtf_data::B

Definition at line 96 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_pbc, and vtf_read_next_timestep.

float vtf_data::beta

Definition at line 96 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_pbc, and vtf_read_next_timestep.

float vtf_data::C

Definition at line 96 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_pbc, and vtf_read_next_timestep.

float* vtf_data::coords

Definition at line 97 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_close_file_read, and vtf_read_next_timestep.

VTFFILE vtf_data::file

Definition at line 74 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_close_file_read, vtf_parse_structure, and vtf_read_next_timestep.

int* vtf_data::from

Definition at line 88 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_close_file_read, vtf_parse_bond, and vtf_read_bonds.

float vtf_data::gamma

Definition at line 96 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_pbc, and vtf_read_next_timestep.

int vtf_data::natoms

Definition at line 82 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_create_atoms_as_needed, vtf_parse_aid_specifier, and vtf_read_structure.

int vtf_data::nbonds

Definition at line 87 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_bond, and vtf_read_bonds.

int vtf_data::optflags

Definition at line 84 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_atom, and vtf_read_structure.

int vtf_data::read_mode

Definition at line 78 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_create_atoms_as_needed, vtf_parse_atom, vtf_parse_structure, and vtf_read_next_timestep.

int vtf_data::return_code

Definition at line 76 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_structure, and vtf_read_structure.

unsigned int vtf_data::timestep

Definition at line 92 of file vtfplugin.c. Referenced by _vtf_open_file_read, and vtf_read_next_timestep.

int vtf_data::timestep_mode

Definition at line 94 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_parse_timestep, and vtf_read_next_timestep.

int* vtf_data::to

Definition at line 89 of file vtfplugin.c. Referenced by _vtf_open_file_read, vtf_close_file_read, vtf_parse_bond, and vtf_read_bonds.

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

• vtfplugin.c

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