From: Nicholas M Glykos (glykos_at_mbg.duth.gr)
Date: Mon Dec 17 2012 - 04:06:22 CST
> Warning: The following variables were set in the
> Warning: configuration file but will be ignored:
> Warning: adaptTempRestartFreq (adaptTempRestartFile)
> Warning: fixedAtomsFile (fixedatoms)
> Warning: fixedAtomsCol (fixedatoms)
Could it be that ? You can test it by adding something like :
adaptTempRestartFile restart.tempering
--
Nicholas M. Glykos, Department of Molecular Biology
and Genetics, Democritus University of Thrace, University Campus,
Dragana, 68100 Alexandroupolis, Greece, Tel/Fax (office) +302551030620,
Ext.77620, Tel (lab) +302551030615, http://utopia.duth.gr/~glykos/
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