[gmx-users] S2 parameter

[Dmitry Kovalsky]

Hi there,

Usually, as I know, in NMR studies the angle  of N-H bond precession is used 
to calculate S2 order parameter.
In contrast,  g_chi program uses Phi, Psi and Omega angles to calculate it. 
How can one  compare order parameters from these two data?
-- 
Sincerely yours,

Dima

Ph.D. Student Dmitry Kovalsky
Institute of Molecular Biology & Genetics
150 Akad. Zabolotnogo Street,
Kiev-143, 03143
UKRAINE

E-mail: dikov at imbg.org.ua
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