kabsch

There are 7 repositories under kabsch topic.

  • charnley/rmsd

    Calculate Root-mean-square deviation (RMSD) of two molecules, using rotation, in xyz or pdb format

    Language:Python4911856114

  • radi0sus/xyzoverlay

    Python 3 script for overlaying or superimposing two or more molecules. The overlayed / superimposed molecules can be displayed and the modified coordinates can be saved as xyz files. Coloring by atom or molecule is possible.

    Language:Python7201

  • ardcore/fit_transform

    Calculate and apply the optimal transformation matrix that minimizes the RMSD (root mean squared deviation) between two paired sets of points.

    Language:JavaScript4200

  • nbehrnd/aRMSD

    Pairwise structural comparison of .xyz, a fork of aRMSD to work without PyInstaller in Linux. Note the project «aRMSD-minimalWindowsSupport», too.

    Language:Python4320

  • sha-kil/kabschjs

    A simple library to compute rigid transformation matrix between two point sets.

    Language:TypeScript1160

  • boneta/RMSD-Clustering

    Clustering based on RMSD

    Language:Python0100

  • nbehrnd/rmsdModerator

    batchwise Kabsch test with Jimmy Charnley's calculate_rmsd (https://github.com/charnley/rmsd) on multiple CPUs

    Language:Python30