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Hello Eugene-- > > This works with all but the JCHB restraints commented out, but I still get > the warning message, so there still seems to be problem if only one set of > restraints is included. However, the average structure is still not output= > , > when I comment out all the dipolar restraints and the potList.append and > rampedParams.append statements. For now, I guess I should be able to > exclude the contributions from the dipolar restraints by just commenting ou= > t > these two statements. > It seems like you have a workaround for now, but I will try to reproduce your results+a fix before the next release. Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.10 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.9 <http://mailcrypt.sourceforge.net/> iEYEARECAAYFAkwowhcACgkQPK2zrJwS/la65QCdH1nFVl1q0Sb4ZPrp8EmZsmEF V44AmwZJYeYShLOwvlt0u0iWUHwv8gWu =JtFG -----END PGP SIGNATURE-----
