Model utilities¶
- posebench.utils.model_utils.calculate_rmsd(positions1: array, positions2: array) float[source]¶
Calculate the root-mean-square deviation (RMSD) between two sets of positions.
- Parameters:
positions1 – Array of positions for the first set of atoms.
positions2 – Array of positions for the second set of atoms.
- Returns:
RMSD between the two sets of positions.