[gmx-users] S2 parameter

Dmitry Kovalsky dikov at imbg.org.ua
Sat Jul 13 10:32:15 CEST 2002

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,


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

E-mail: dikov at imbg.org.ua
Fax:  +380 (44) 266-0759
Tel.: +380 (44) 266-5589

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