Commit | Date | |
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[r23214]
by
tlinnet
Created branch for the testing of speeding up dispersion analysis. This can be a disruptive process, and needs its own branch. task #7793:(https://gna.org/task/?7793) Speed-up of dispersion models. |
2014-05-18 19:25:45 | Tree |
[r23213]
by
tlinnet
Branch "disp_speed" deleted, since svnmerge.py give a strange error: |
2014-05-18 19:24:01 | Tree |
[r23212]
by
tlinnet
Initialized merge tracking via "svnmerge" with revisions "1-23149" from |
2014-05-18 18:16:05 | Tree |
[r23211]
by
bugman
Fix for a number of the frame order models which do not have parameter constraints. The linear_constraint() function was returning A, b = [], [] for these models, but these empty numpy |
2014-05-17 16:03:46 | Tree |
2014-05-17 16:03:44 | Tree | |
[r23209]
by
bugman
Parameter update for the isotropic cone CaM frame order test model optimisation script. The Euler angles for the rotation about the motional pivot have been replaced by the translation |
2014-05-16 14:55:55 | Tree |
[r23208]
by
bugman
Updated the CaM frame order test model superimposition script. The structure.superimpose user function is now correctly called. The output log file has been added |
2014-05-16 14:36:45 | Tree |
[r23207]
by
bugman
Merged revisions 23206 via svnmerge from ........ |
2014-05-16 14:32:44 | Tree |
[r23206]
by
bugman
Added the 'centre_type' argument to the structure.superimpose user function. This allows the default 'centroid' superimposition to be replaced by a centre of mass (CoM) |
2014-05-16 14:32:03 | Tree |
[r23205]
by
bugman
Created a script for the CaM frame order test models for finding the average domain position. As the rotation about a fixed pivot has been eliminated, the shift from 1J7P_1st_NH_rot.pdb to |
2014-05-16 13:55:40 | Tree |