Welcome to the relax Wiki.
| The community-run support site for relax, a program for the study of molecular dynamics using experimental NMR data.
|
User contributions - How to edit pages at the wiki
Please read the guidelines here.
What's new?
|
|
Did you know...
The relaxation dispersion model for the numeric solution (NS) to the Bloch-McConnell equations for SQ CPMG-type data using complex conjugate matrices. The model is labelled as NS CPMG 2-site star full in relax.
Parameters
The NS CPMG 2-site star full model has the parameters {R2A0, R2B0, ..., pA, Δω, kex}.
Code
The library code: https://sourceforge.net/p/nmr-relax/code/ci/master/tree/lib/dispersion/ns_cpmg_2site_star.py
References
The function uses an explicit matrix that contains relaxation, exchange and chemical shift terms. It does the 180 deg pulses in the CPMG train with conjugate complex matrices. The approach of Bloch-McConnell can be found in chapter 3.1 of Palmer, A. G. 2004 Chem. Rev., 104, 3623-3640. This function was written, ..→
|
|
|
Random screenshots
The analysis selection wizard
Steady-state NOE analysis
|
|