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SVN archive Commit Log


Commit Date  
[r15306] by bugman

Updated all the frame order test data README files for the recent directory changes.

2012-02-06 08:06:23 Tree
[r15305] by bugman

Updated the chi2 value for the isotropic cone frame order system tests.

2012-02-03 15:25:56 Tree
[r15304] by bugman

Increased the number of integration points for the isotropic cone frame order model system test.

50 points is not enough, as none land within the cone!

2012-02-03 15:24:30 Tree
[r15303] by bugman

The exact chi2 values are now checked in all the frame order system tests.

Some of these values are obviously incorrect, and will be fixed later.

2012-02-03 15:00:38 Tree
[r15302] by bugman

The frame order system test scripts can now operate as stand alone scripts.

2012-02-03 12:59:08 Tree
[r15301] by bugman

Fix for the quasi-random numerical integration of the torsionless frame order model.

2012-02-03 12:41:03 Tree
[r15300] by bugman

Fix for the frame order cone PDB creation for the models with the cone_s1 order parameter.

The cone angle is no longer stored as cdp.cone_theta, so is now generated on the fly.

2012-02-03 12:38:36 Tree
[r15299] by bugman

The theta and phi Sobol angles are now correctly unpacked.

2012-02-03 11:22:47 Tree
[r15298] by bugman

The phi angle sampling in the iso cone frame order models has been reintroduced.

2012-02-03 11:22:00 Tree
[r15297] by bugman

Fixes for all of the free-rotor frame order models - the sigma angle needs to be sampled!

2012-02-03 11:17:21 Tree
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