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moldendata_t Struct Reference

List of all members.

Public Attributes

long filepos_atoms
long filepos_geomxyz
long filepos_gto
long filepos_mo
char units [16]
int coordsonly

Member Data Documentation

int moldendata_t::coordsonly
 

Definition at line 70 of file moldenplugin.c.

Referenced by open_molden_read, read_molden_metadata, read_molecular_orbitals, and read_qm_timestep_metadata.

long moldendata_t::filepos_atoms
 

Definition at line 65 of file moldenplugin.c.

Referenced by open_molden_read, and read_molden_structure.

long moldendata_t::filepos_geomxyz
 

Definition at line 66 of file moldenplugin.c.

Referenced by open_molden_read, and read_molden_structure.

long moldendata_t::filepos_gto
 

Definition at line 67 of file moldenplugin.c.

Referenced by get_basis, and open_molden_read.

long moldendata_t::filepos_mo
 

Definition at line 68 of file moldenplugin.c.

Referenced by count_orbitals, open_molden_read, and read_molecular_orbitals.

char moldendata_t::units[16]
 

Definition at line 69 of file moldenplugin.c.

Referenced by open_molden_read, and read_molden_structure.


The documentation for this struct was generated from the following file:
Generated on Tue Aug 11 03:06:56 2020 for VMD Plugins (current) by doxygen1.2.14 written by Dimitri van Heesch, © 1997-2002