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Hello-- > I am using IVM and Pararestraints to refine one > structure. But I checked the output PDB file and the > tensors axes are not orthogonal. Can anybody help me > check my script to see where the problem comes from. the only thing I would add to John's response is that this sort of problem is much less likely if you use the Python interface. See, for instance, eginput/gb1_rdc/anneal.py best regards-- Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.6 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8+ <http://mailcrypt.sourceforge.net/> iD8DBQFHW9OtPK2zrJwS/lYRArX3AJ99woTkZs/wX+A4mCnhWOwxU5GieQCeOX6a TJllwGNWeTlaOyxzts5fWZ0= =ED3Y -----END PGP SIGNATURE-----
