pdb2sql.superpose.superpose_selection¶
- pdb2sql.superpose.superpose_selection(xyz_mobile, selection_mobile, selection_target, method)[source]¶
superpose the xyz using the selection
- Parameters:
aligned (xyz_mobile {np.ndarray} -- xyz to be) –
superposition (selection_target {np.ndarray} -- xyz of the target used for the) –
superposition –
quaternion (method {str} -- svd or) –
- Returns:
np.ndarray – xyz of the xyz_mobile