CCL: Calulate RMSD

[Kyle Lutz <kyle.r.lutz]~[gmail.com>]

 Sent to CCL by: Kyle Lutz [kyle.r.lutz:-:gmail.com]
 >> Sent to CCL by: "Fabio  Coelho" [fabioamsc- -ig.com.br]
 >> Hi all,
 >>
 >> I would like to know if there are some programs (free) that calculate
 the
 >> RMSD to docked ligands and the crystallographic.
 Hi Fabio,
 The open-source chemkit library can calculate the RMSD between two
 molecules. See the rmsd() method of the MoleculeAligner class
 (http://doc.chemkit.org/api/classchemkit_1_1_molecule_aligner.html).
 Let me know if you have any questions or would like to see some example code.
 Cheers,
 Kyle