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psfdata Struct Reference

List of all members.

Public Attributes

FILE * fp
int numatoms
int namdfmt
int charmmfmt
int charmmcmap
int charmmcheq
int charmmext
int charmmdrude
int nbonds
int * from
int * to
int numangles
int * angles
int numdihedrals
int * dihedrals
int numimpropers
int * impropers
int numcterms
int * cterms

Member Data Documentation

int * psfdata::angles
 

Definition at line 40 of file psfplugin.c.

Referenced by close_psf_read, close_psf_write, read_angles, write_angles, and write_psf_structure.

int psfdata::charmmcheq
 

Definition at line 35 of file psfplugin.c.

Referenced by open_psf_read, and open_psf_write.

int psfdata::charmmcmap
 

Definition at line 34 of file psfplugin.c.

Referenced by open_psf_read, open_psf_write, and write_psf_structure.

int psfdata::charmmdrude
 

Definition at line 37 of file psfplugin.c.

Referenced by open_psf_read, open_psf_write, and read_psf.

int psfdata::charmmext
 

Definition at line 36 of file psfplugin.c.

Referenced by open_psf_read, open_psf_write, read_bonds, read_psf, and write_psf_structure.

int psfdata::charmmfmt
 

Definition at line 33 of file psfplugin.c.

Referenced by open_psf_read, open_psf_write, and write_psf_structure.

int * psfdata::cterms
 

Definition at line 43 of file psfplugin.c.

Referenced by close_psf_read, close_psf_write, read_angles, write_angles, and write_psf_structure.

int * psfdata::dihedrals
 

Definition at line 41 of file psfplugin.c.

Referenced by close_psf_read, close_psf_write, read_angles, write_angles, and write_psf_structure.

FILE* psfdata::fp
 

Definition at line 30 of file psfplugin.c.

Referenced by close_psf_read, close_psf_write, open_psf_read, open_psf_write, read_angles, read_bonds, read_psf, and write_psf_structure.

int* psfdata::from
 

Definition at line 39 of file psfplugin.c.

Referenced by close_psf_read, close_psf_write, open_psf_write, read_bonds, write_bonds, and write_psf_structure.

int * psfdata::impropers
 

Definition at line 42 of file psfplugin.c.

Referenced by close_psf_read, close_psf_write, read_angles, write_angles, and write_psf_structure.

int psfdata::namdfmt
 

Definition at line 32 of file psfplugin.c.

Referenced by open_psf_read, open_psf_write, read_bonds, read_psf, and write_psf_structure.

int psfdata::nbonds
 

Definition at line 38 of file psfplugin.c.

Referenced by open_psf_write, write_bonds, and write_psf_structure.

int psfdata::numangles
 

Definition at line 40 of file psfplugin.c.

Referenced by read_angles, write_angles, and write_psf_structure.

int psfdata::numatoms
 

Definition at line 31 of file psfplugin.c.

Referenced by open_psf_read, open_psf_write, read_psf, and write_psf_structure.

int psfdata::numcterms
 

Definition at line 43 of file psfplugin.c.

Referenced by read_angles, write_angles, and write_psf_structure.

int psfdata::numdihedrals
 

Definition at line 41 of file psfplugin.c.

Referenced by read_angles, write_angles, and write_psf_structure.

int psfdata::numimpropers
 

Definition at line 42 of file psfplugin.c.

Referenced by read_angles, write_angles, and write_psf_structure.

int * psfdata::to
 

Definition at line 39 of file psfplugin.c.

Referenced by close_psf_read, close_psf_write, open_psf_write, read_bonds, write_bonds, and write_psf_structure.


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