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Molecular dynamics by NMR data analysis

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Commit [r21143] Maximize Restore History

Added scripts and results for optimising Sprangers' ClpP MQ CPMG data to the 'MQ NS CPMG 2-site' model.

This includes two scripts for non-clustered followed by clustered analysis using the 'MQ CR72' model
in the auto-analysis so its parameters will be used as the optimisation starting point for the
'MQ NS CPMG 2-site' model. The results files for both scripts have been added to the repository.

Authored by: bugman 2013-10-16

Browse code at this revision

Parent: [r21142]

Child: [r21144]

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added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/chi2.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/disp_135_F.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/disp_135_S.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/disp_137_F.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/disp_137_S.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/dw.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/dw.out
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/dwH.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/dwH.out
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/grace2images.py
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/k_AB.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/k_AB.out
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/kex.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/kex.out
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/pA.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/pA.out
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/pB.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/pB.out
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/results.bz2
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/tex.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/MQ NS CPMG 2-site/tex.out
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/No Rex
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/No Rex/chi2.agr
added	/branches/relax_disp/test_suite/shared_data/dispersion/Sprangers_ClpP/analysis/No Rex/disp_135_F.agr