atomes 1.1.14
atomes: an atomic scale modeling tool box
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Functions to retrieve data in the force field structure. More...
#include "dlp_field.h"
Go to the source code of this file.
Functions | |
field_molecule * | get_active_field_molecule_from_model_id (project *this_proj, int aid) |
retrieve field molecule from overall atom id in the model | |
field_molecule * | get_active_field_molecule (int a) |
retrieve field molecule | |
field_nth_body * | get_active_body (int a, int b) |
retrieve field nth body interaction | |
field_external * | get_active_external (int a) |
retrieve external field property | |
field_atom * | get_active_atom (int a, int b) |
retrieve field atom | |
field_shell * | get_active_shell (int a, int b) |
retrieve shell property | |
field_constraint * | get_active_constraint (int a, int b) |
retrieve constraint property | |
field_pmf * | get_active_pmf (int a, int b) |
retrieve PMF property | |
field_rigid * | get_active_rigid (int a, int b) |
retrieve rigid property | |
field_tethered * | get_active_tethered (int a, int b) |
retrieve tethered property | |
field_prop * | get_active_prop (struct field_prop *pr, int a) |
the field molecule structural property id to retrieve | |
field_prop * | get_active_prop_using_atoms (struct field_prop *pr, int ti, int *ids) |
retrieve field molecule structural property using atoms | |
field_struct * | get_active_struct (int s, int a, int b) |
retrieve field structural property | |
Functions to retrieve data in the force field structure.
Definition in file dlp_active.c.
field_atom * get_active_atom | ( | int | a, |
int | b ) |
retrieve field atom
a | the id of the field molecule |
b | the id of the field atom to retrieve |
Definition at line 145 of file dlp_active.c.
field_nth_body * get_active_body | ( | int | a, |
int | b ) |
retrieve field nth body interaction
a | the id of the body interaction to retrieve |
b | the type of body interaction |
Definition at line 106 of file dlp_active.c.
field_constraint * get_active_constraint | ( | int | a, |
int | b ) |
retrieve constraint property
a | the id of the field molecule |
b | the id of the constraint to retrieve |
Definition at line 185 of file dlp_active.c.
field_external * get_active_external | ( | int | a | ) |
retrieve external field property
a | the id of the external field property to retrieve |
Definition at line 125 of file dlp_active.c.
field_molecule * get_active_field_molecule | ( | int | a | ) |
retrieve field molecule
a | the id of the field molecule to retrieve |
Definition at line 87 of file dlp_active.c.
field_molecule * get_active_field_molecule_from_model_id | ( | project * | this_proj, |
int | aid ) |
retrieve field molecule from overall atom id in the model
this_proj | the target project |
aid | the target atom id |
Definition at line 59 of file dlp_active.c.
field_pmf * get_active_pmf | ( | int | a, |
int | b ) |
retrieve PMF property
a | the id of the field molecule |
b | the id of the PMF property to retrieve |
Definition at line 205 of file dlp_active.c.
field_prop * get_active_prop | ( | struct field_prop * | pr, |
int | a ) |
the field molecule structural property id to retrieve
pr | the pointer on the field molecule properties to browse |
a | the id of the field molecule property to retrieve |
Definition at line 265 of file dlp_active.c.
field_prop * get_active_prop_using_atoms | ( | struct field_prop * | pr, |
int | ti, | ||
int * | ids ) |
retrieve field molecule structural property using atoms
pr | the pointer on the field molecule properties to browse |
ti | the number of atoms for this property |
ids | the atoms to search for |
Definition at line 286 of file dlp_active.c.
field_rigid * get_active_rigid | ( | int | a, |
int | b ) |
retrieve rigid property
a | the id of the field molecule |
b | the id of the rigid property to retrieve |
Definition at line 225 of file dlp_active.c.
field_shell * get_active_shell | ( | int | a, |
int | b ) |
retrieve shell property
a | the id of the field molecule |
b | the id of the shell property to retrieve |
Definition at line 165 of file dlp_active.c.
field_struct * get_active_struct | ( | int | s, |
int | a, | ||
int | b ) |
retrieve field structural property
s | the type of structural property |
a | the field molecule id |
b | the structural property id to retrieve |
Definition at line 318 of file dlp_active.c.
field_tethered * get_active_tethered | ( | int | a, |
int | b ) |
retrieve tethered property
a | the id of the field molecule |
b | the id of the tethered to retrieve |
Definition at line 245 of file dlp_active.c.