A protein structure comparison method is described
that allows the generation of large populations of high-scoring
alternate alignments. This was achieved by incorporating
a random element into an iterative double dynamic programming
algorithm. The maximum scores from repeated comparisons
of a pair of structures converged on a value that was taken
as the global maximum. This lay 15% over the score obtained
from the single fixed (unrandomized) calculation. The effect
of the gap penalty was observed through the shift of the
alignment populations, characterized by their alignment
length and root-mean-square deviation (RMSD). The best
(lowest RMSD) values found in these populations provided
a base-line against which other methods were compared.