Files | |
| file | valist.h |
| Contains declarations for class Valist. | |
Data Structures | |
| struct | sValist |
| Container class for list of atom objects. More... | |
Typedefs | |
| typedef sValist | Valist |
| Declaration of the Valist class as the Valist structure. | |
Functions | |
| Vatom * | Valist_getAtomList (Valist *thee) |
| Get actual array of atom objects from the list. | |
| double | Valist_getCenterX (Valist *thee) |
| Get x-coordinate of molecule center. | |
| double | Valist_getCenterY (Valist *thee) |
| Get y-coordinate of molecule center. | |
| double | Valist_getCenterZ (Valist *thee) |
| Get z-coordinate of molecule center. | |
| int | Valist_getNumberAtoms (Valist *thee) |
| Get number of atoms in the list. | |
| Vatom * | Valist_getAtom (Valist *thee, int i) |
| Get pointer to particular atom in list. | |
| unsigned long int | Valist_memChk (Valist *thee) |
| Get total memory allocated for this object and its members. | |
| Valist * | Valist_ctor () |
| Construct the atom list object. | |
| int | Valist_ctor2 (Valist *thee) |
| FORTRAN stub to construct the atom list object. | |
| void | Valist_dtor (Valist **thee) |
| Destroys atom list object. | |
| void | Valist_dtor2 (Valist *thee) |
| FORTRAN stub to destroy atom list object. | |
| int | Valist_readPQR (Valist *thee, Vio *sock) |
| Fill atom list with information from a PQR file. | |
| int | Valist_readPDB (Valist *thee, Vparam *param, Vio *sock) |
| Fill atom list with information from a PDB file. | |
|
|
Construct the atom list object.
|
|
|
FORTRAN stub to construct the atom list object.
|
|
|
Destroys atom list object.
|
|
|
FORTRAN stub to destroy atom list object.
|
|
||||||||||||
|
Get pointer to particular atom in list.
|
|
|
Get actual array of atom objects from the list.
|
|
|
Get x-coordinate of molecule center.
|
|
|
Get y-coordinate of molecule center.
|
|
|
Get z-coordinate of molecule center.
|
|
|
Get number of atoms in the list.
|
|
|
Get total memory allocated for this object and its members.
|
|
||||||||||||||||
|
Fill atom list with information from a PDB file.
|
|
||||||||||||
|
Fill atom list with information from a PQR file.
|
1.3.5