9 lines
341 B
Plaintext
9 lines
341 B
Plaintext
Calculate Root-mean-square deviation (RMSD) of Two Molecules Using Rotation.
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The root-mean-square deviation (RMSD) is calculated, using Kabsch
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algorithm (1976) or Quaternion algorithm (1991) for rotation, between two
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Cartesian coordinates in either .xyz or .pdb format, resulting in the minimal
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RMSD.
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WWW: https://github.com/charnley/rmsd
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