Class QuatSuperpositionScorer

    • Method Detail

      • calcScores

        public static QuatSymmetryScores calcScores​(QuatSymmetrySubunits subunits,
                                                    javax.vecmath.Matrix4d transformation,
                                                    List<Integer> permutation)
        Returns minimum, mean, and maximum RMSD and TM-Score for two superimposed sets of subunits TM score: Yang Zhang and Jeffrey Skolnick, PROTEINS: Structure, Function, and Bioinformatics 57:702–710 (2004)
        Parameters:
        subunits - subunits to be scored
        transformation - transformation matrix
        permutations - permutation that determines which subunits are superposed
        Returns: