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Commit Date  
[r24098] by tlinnet

Copied profiling script of DPL94 to ns r1rho 2site.

2014-06-18 14:44:12 Tree
[r24097] by bugman

The disp_profile_all.py super script now prints out the current relax version information.

This is so that the log files contain information about the repository revision and path.

2014-06-18 14:39:53 Tree
[r24096] by tlinnet

Fix for the profiling script of NS cpmg 3D.

The model should also be speciffied to full.

Task #7807 (https://gna.org/task/index.php?7807): Speed-up of dispersion models for Clustered analysis.

2014-06-18 14:33:46 Tree
[r24095] by tlinnet

Changes to profiling script of ns expanded.

The unpacking can be removed.

Task #7807 (https://gna.org/task/index.php?7807): Speed-up of dispersion models for Clustered analysis.

2014-06-18 14:17:42 Tree
[r24094] by tlinnet

Made changes to the profiling script of NS_CPMG_2SITE_3D.

Need to use the full model, when r2a and r2b is specified.

Task #7807 (https://gna.org/task/index.php?7807): Speed-up of dispersion models for Clustered analysis.

2014-06-18 14:07:10 Tree
[r24093] by tlinnet

Changes to profiling script of ns_cpmg_2site_expanded.

The model does not have r20a and r20b, but only r2.

Task #7807 (https://gna.org/task/index.php?7807): Speed-up of dispersion models for Clustered analysis.

2014-06-18 14:03:46 Tree
[r24092] by tlinnet

Modified profiling script for TSMK01, to use correct parameters k_AB and r20a.

Or else, the lib functions is just calculating with zero?

Task #7807 (https://gna.org/task/index.php?7807): Speed-up of dispersion models for Clustered analysis.

2014-06-18 13:58:31 Tree
[r24091] by tlinnet

Added DPL94 profiling script.

Task #7807 (https://gna.org/task/index.php?7807): Speed-up of dispersion models for Clustered analysis.

2014-06-18 13:44:58 Tree
[r24090] by bugman

Support for the 3 vector system for double motions has been added to the frame order analysis.

This is used for the quasi-random Sobol' numeric integration of the PCS. The lanthanide to atom
vector is the sum of three parts: the 1st pivot to atom vector rotated by the 1st mode of motion;
the 2nd pivot to 1st pivot vector rotated by the 2nd mode of motion (together with the rotated 1st
pivot to atom vectors); and the lanthanide to second pivot vector.

All these vectors are passed into the lib.frame_order.double_rotor.pcs_numeric_int_double_rotor()
function, which passes them to the pcs_pivot_motion_double_rotor() function where they are rotated
and reconstructed into the Ln3+ to atom vectors.

2014-06-18 13:38:33 Tree
[r24089] by bugman

Added the 'NS CPMG 2-site 3D' model to the dispersion super profiling script.

To handle the fact that this script has nr_iter set to 100 rather than 1000 (as otherwise it is too
slow), a list of scaling factors has been created to scale all timing numbers to equivalent values.

2014-06-18 13:22:21 Tree
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