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Tutorial for model free SBiNLab

957 bytes added, 17:23, 15 October 2017
pymol -c 06_check_intermediate_pymol.pml
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=== 06_check_intermediate_convert.py - Create input for other programs ===
Relax can create input files to other program, to help verify the results. <br>
This is mentioned here:
* d'Auvergne, E. J. and Gooley, P. R. (2008). [http://dx.doi.org/10.1007/s10858-007-9214-2 Optimisation of NMR dynamic models I. Minimisation algorithms and their performance within the model-free and Brownian rotational diffusion spaces. J. Biomol. NMR, 40(2), 107-119.]
 
There exist some model-free programs for analysis
* Modelfree (Palmer et al. 1991; Mandel et al. 1995) - most commonly used program in the literature is the Modelfree program
* Dasha (Orekhov et al. 1995a) - two local optimisation algorithms are available.
* DYNAMICS (Fushman et al. 1997)
* Tensor 2 (Blackledge et al. 1998; Cordier et al. 1998; Dosset et al. 2000; Tsan et al. 2000).
 
Relax can export output to
* Modelfree4 : User function: palmer.create()
* dasha : User function: dasha.create()
= To run on Haddock =
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