Re: creating an output file from a dcd file

From: Nicholas M Glykos (
Date: Tue Mar 02 2010 - 15:11:54 CST

> I didn't mean the output file as in the dcd file, but I meant the log
> file where you have your TS, Energies, Electrostatics..etc recorded

In that case have a look at

          Dr 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,

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