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gmxdata Struct Reference

List of all members.

Public Attributes

md_filemf
int natoms
int step
float timeval
molfile_atom_tatomlist
molfile_metadata_tmeta

Member Data Documentation

molfile_atom_t* gmxdata::atomlist
 

Definition at line 45 of file gromacsplugin.C.

Referenced by close_gro_write, write_gro_structure, and write_gro_timestep.

molfile_metadata_t* gmxdata::meta
 

Definition at line 46 of file gromacsplugin.C.

Referenced by close_gro_read, close_gro_write, open_gro_read, open_gro_write, and read_gro_molecule_metadata.

md_file* gmxdata::mf
 

Definition at line 41 of file gromacsplugin.C.

Referenced by close_g96_read, close_gro_read, close_gro_write, close_trr_read, close_trr_write, open_g96_read, open_gro_read, open_gro_write, open_trr_read, open_trr_write, read_g96_structure, read_g96_timestep, read_gro_structure, read_gro_timestep, read_trr_timestep, write_gro_timestep, and write_trr_timestep.

int gmxdata::natoms
 

Definition at line 42 of file gromacsplugin.C.

Referenced by open_g96_read, open_gro_read, open_gro_write, open_trr_read, open_trr_write, read_g96_structure, read_g96_timestep, read_gro_structure, read_gro_timestep, read_trr_timestep, write_gro_structure, write_gro_timestep, and write_trr_timestep.

int gmxdata::step
 

Definition at line 43 of file gromacsplugin.C.

Referenced by open_gro_write, open_trr_write, and write_trr_timestep.

float gmxdata::timeval
 

Definition at line 44 of file gromacsplugin.C.

Referenced by open_gro_read.


The documentation for this struct was generated from the following file:
Generated on Tue Jan 21 02:56:35 2020 for VMD Plugins (current) by doxygen1.2.14 written by Dimitri van Heesch, © 1997-2002