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colvarcomp_distances.C File Reference

#include <algorithm>
#include "colvarmodule.h"
#include "colvarvalue.h"
#include "colvarparse.h"
#include "colvar.h"
#include "colvarcomp.h"

Go to the source code of this file.

Functions

 simple_scalar_dist_functions (distance) colvar
 simple_scalar_dist_functions (gyration) colvar
 simple_scalar_dist_functions (inertia_z) colvar
 simple_scalar_dist_functions (rmsd) colvar
 simple_scalar_dist_functions (eigenvector) colvar


Function Documentation

simple_scalar_dist_functions eigenvector   
 

Definition at line 1509 of file colvarcomp_distances.C.

References atoms, conf, colvarmodule::error, NULL, and colvarvalue::type_vector.

simple_scalar_dist_functions rmsd   
 

Definition at line 1216 of file colvarcomp_distances.C.

References atoms, COLVARS_INPUT_ERROR, conf, colvardeps::disable, colvardeps::enable, colvarmodule::error, colvardeps::is_enabled, colvarmodule::load_coords, colvarmodule::log, colvarmodule::sqrt, and colvarvalue::type_scalar.

simple_scalar_dist_functions inertia_z   
 

Definition at line 903 of file colvarcomp_distances.C.

References COLVARS_INPUT_ERROR, conf, colvarmodule::error, and colvarmodule::log.

simple_scalar_dist_functions gyration   
 

Definition at line 867 of file colvarcomp_distances.C.

References conf.

simple_scalar_dist_functions distance   
 

Definition at line 97 of file colvarcomp_distances.C.

References conf, and colvarvalue::type_3vector.


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