diff --git a/src/BioHelpers_FABER/rmsd.py b/src/BioHelpers_FABER/rmsd.py index 27a4726965e1a05a8444b5e86a814d8c9f3bda7d..8dcb43bf45549467d7d39d9f7f2a93f6483a87a6 100644 --- a/src/BioHelpers_FABER/rmsd.py +++ b/src/BioHelpers_FABER/rmsd.py @@ -102,7 +102,7 @@ def rmsd_from_rot_tran( """Calculate an RMSD like value for a given set of vectors x and y with a given rotation matrix and translation vector Mathematical formula: - .. math:: \tile{\mathrm{RMSD}} = \\frac{1}{M} \sum_{k=1..M} |\mathscr{U}\mathbf{x}^k + \mathbf{r} - \mathbf{y}^k|^2 + .. math:: \tilde{\mathrm{RMSD}} = \\frac{1}{M} \sum_{k=1..M} |\mathscr{U}\mathbf{x}^k + \mathbf{r} - \mathbf{y}^k|^2 **Important Note:** The translation vector differs from Kabsch algorithm, there you translate befor rotating. In Coutsias paper it is the otherway round.