-----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1
Hello Hongyan-- > I am trying to test the script eginput/gb1_rdc/refine.py. It seems if the PSF > was generated with seq file, however, when I used model.pdb to generate psf > file, error appears as follow: > -atom selection must contain at least one atom. > B-atom selection must contain at least one atom. > RDCPot::addRestraints: error adding restraint: () () 11.6641 0.2 0.2 ! what does your rdc assignment table look like? This message indicates that there is one or more bad entries which you might identify by the rdc values (11.6641). best regards-- Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.6 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8 <http://mailcrypt.sourceforge.net/> iD8DBQFF8XMVPK2zrJwS/lYRAvfXAJ0dOCZnbOnAFkYalp6e2P/pGTwZ6QCbBp7j 41AP8H1FlVgfe6cKmQUOXLg= =BB3U -----END PGP SIGNATURE-----
