Author: bugman Date: Thu May 15 15:54:38 2014 New Revision: 23191 URL: http://svn.gna.org/viewcvs/relax?rev=23191&view=rev Log: Modified the 2nd rotor model of CaM frame order optimisation script. The frame_order.pdb_model user function is now used to create a PDB representation of the rotor motions for the real, expected parameters and for the optimisation results when the pivot point is fixed. In addition, the pymol.cone_pdb user function has been replaced by the pymol.frame_order user function. All new files have been added to the repository. Added: trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos_fixed_piv.pdb - copied, changed from r23190, trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos.pdb trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.pdb trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order_fixed_piv.pdb trunk/test_suite/shared_data/frame_order/cam/rotor2/true_frame_order.pdb Modified: trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos.pdb trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.bz2 trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.log trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py [This mail would be too long, it was shortened to contain the URLs only.] Modified: trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos.pdb URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos.pdb?rev=23191&r1=23190&r2=23191&view=diff Copied: trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos_fixed_piv.pdb (from r23190, trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos.pdb) URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos_fixed_piv.pdb?p2=trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos_fixed_piv.pdb&p1=trunk/test_suite/shared_data/frame_order/cam/rotor2/ave_pos.pdb&r1=23190&r2=23191&rev=23191&view=diff Modified: trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.bz2 URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.bz2?rev=23191&r1=23190&r2=23191&view=diff Modified: trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.log URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.log?rev=23191&r1=23190&r2=23191&view=diff Added: trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.pdb URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.pdb?rev=23191&view=auto Modified: trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order.py?rev=23191&r1=23190&r2=23191&view=diff Added: trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order_fixed_piv.pdb URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/frame_order_fixed_piv.pdb?rev=23191&view=auto Added: trunk/test_suite/shared_data/frame_order/cam/rotor2/true_frame_order.pdb URL: http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/frame_order/cam/rotor2/true_frame_order.pdb?rev=23191&view=auto