mailRe: Brownian rotational diffusion mini-tutorial.


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Posted by Edward d'Auvergne on October 26, 2006 - 17:24:
I forgot to mention that relax can be used to easily convert between
the different rotational diffusion parameter sets.  For instance if
you have a relax model-free results file for spheroidal diffusion
(axial symmetry) and you would like to convert the parameters {tm, Da}
into {tm, Dratio} or {Dper, Dpar}, type something like:

relax> run.create('prolate', 'mf')
relax> results.read('prolate', file='results.bz2', dir=None)
Opening the file 'results.bz2' for reading.

relax> diffusion_tensor.display('prolate')

This will print out all the different parameter values.

Edward



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