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pdbdata Struct Reference

List of all members.

Public Attributes

FILE * fd
int natoms
char * original_file
char * current_file
int babel_num
int babel_i
FILE * fd
int first_frame
molfile_atom_tatomlist
molfile_metadata_tmeta
int nconect
int nbonds
int maxbnum
int * from
int * to
int * idxmap
char * pdbstr
char * pos
molfile_metadata_tmeta
int * from

Member Data Documentation

molfile_atom_t* pdbdata::atomlist
 

Definition at line 40 of file pdbplugin.c.

Referenced by close_file_write, open_file_write, open_pdb_read, write_structure, and write_timestep.

int pdbdata::babel_i
 

Definition at line 46 of file babelplugin.c.

Referenced by open_babel_read, and read_next_timestep.

int pdbdata::babel_num
 

Definition at line 45 of file babelplugin.c.

Referenced by open_babel_read, and read_next_timestep.

char* pdbdata::current_file
 

Definition at line 44 of file babelplugin.c.

Referenced by close_pdb_read, open_babel_read, and read_next_timestep.

FILE* pdbdata::fd
 

Definition at line 37 of file pdbplugin.c.

FILE* pdbdata::fd
 

Definition at line 41 of file babelplugin.c.

Referenced by close_file_write, close_pdb_read, open_file_write, open_pdb_read, read_next_timestep, read_pdb_structure, and write_timestep.

int pdbdata::first_frame
 

Definition at line 38 of file pdbplugin.c.

Referenced by open_file_write, and write_timestep.

int* pdbdata::from
 

Definition at line 83 of file webpdbplugin.c.

int* pdbdata::from
 

Definition at line 44 of file pdbplugin.c.

Referenced by open_pdb_read, pdb_read, read_bonds, and read_pdb_structure.

int * pdbdata::idxmap
 

Definition at line 83 of file webpdbplugin.c.

Referenced by close_pdb_read, open_pdb_read, pdb_read, and read_pdb_structure.

int pdbdata::maxbnum
 

Definition at line 82 of file webpdbplugin.c.

Referenced by open_pdb_read, pdb_read, and read_pdb_structure.

molfile_metadata_t* pdbdata::meta
 

Definition at line 80 of file webpdbplugin.c.

molfile_metadata_t* pdbdata::meta
 

Definition at line 41 of file pdbplugin.c.

Referenced by close_pdb_read, open_pdb_read, pdb_read, and read_molecule_metadata.

int pdbdata::natoms
 

Definition at line 79 of file webpdbplugin.c.

Referenced by open_file_write, open_pdb_read, pdb_read, read_bonds, read_next_timestep, read_pdb_structure, write_structure, and write_timestep.

int pdbdata::nbonds
 

Definition at line 82 of file webpdbplugin.c.

Referenced by open_pdb_read, pdb_read, read_bonds, and read_pdb_structure.

int pdbdata::nconect
 

Definition at line 81 of file webpdbplugin.c.

Referenced by open_pdb_read, pdb_read, and read_bonds.

char* pdbdata::original_file
 

Definition at line 43 of file babelplugin.c.

Referenced by open_babel_read, and read_next_timestep.

char* pdbdata::pdbstr
 

Definition at line 77 of file webpdbplugin.c.

Referenced by close_pdb_read, pdb_read, and read_pdb_structure.

char* pdbdata::pos
 

Definition at line 78 of file webpdbplugin.c.

Referenced by pdb_read, and read_next_timestep.

int * pdbdata::to
 

Definition at line 83 of file webpdbplugin.c.

Referenced by open_pdb_read, pdb_read, read_bonds, and read_pdb_structure.


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