[gmx-users] S2 order parameters

rams rams rams.crux at gmail.com
Thu Sep 11 00:33:18 CEST 2008


Dear users,

The S2 order parameters obtained by using g_chi, are they corresponds to the
Lipari_Szabo NMR order parameters for characterizing the internal motions?

Also it is mentioned in the manual that the obtained S2 parameter
corresponds to a dihedral and the generated plot is residue vs S2. Does it
mean that the S2 parameters are averaged on each residue ??

Thanks in advance.
Ram.
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