coordinate_manipulations.c File Reference

#include <mylib.h>
#include <molecules.h>
#include <geometries.h>

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Functions
double	get_distance_AB_points (coord_3D a, coord_3D b)
double	get_angle_between_vectors (vectormag_3D a, vectormag_3D b)
double	get_angle_ABC_points (coord_3D a, coord_3D b, coord_3D c)
double	get_dihedral_ABCD_points (coord_3D a, coord_3D b, coord_3D c, coord_3D d)
void	translate_coords_dp_list (coord_3D **coords, int num_coords, coord_3D shift)
void	orient_coords2_to_coords1_dp_list (coord_3D **coords, int num_coords, const coord_3D *bond_atom_a, coord_3D *bond_atom_b, double distance, const coord_3D *angle_atom_a, double theta, coord_3D *angle_atom_b, double rho, const coord_3D *dih_atom_a, coord_3D *dih_atom_b, double tau, const coord_3D *tor_atom_a, const coord_3D *ref_angle_a, double phi, coord_3D *tor_atom_b, coord_3D *ref_atom_b, double omega)