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Jiro Takei <[email protected]> wrote: > I'm having a problem here... > > Sometimes, only sometimes, my structure refinement with RDC stops in the > first step of dynamics with no error message. The input file that I'm > using is basically the same as the one in example directory, except that > mine uses internal dynamics instead of verlet. There is a problem with the standard xplor-nih releases on the compute nodes of biowulf. The problem should be resolved with a new special version (2.0.6-biowulf) of xplor-nih which was installed today on the cluster. best regards-- Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.2.1 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8 <http://mailcrypt.sourceforge.net/> iD8DBQE+eiTfPK2zrJwS/lYRAjIYAJ47E20dVgcrWhizwvRMczmbic9QiwCeICbr rMRrnkoh5DG1RnPbvvTQxoQ= =J2Wg -----END PGP SIGNATURE-----
