Hi,
A couple of weeks ago I noticed that my scripts that rotates a structure
and translates it to align with another didn't work anymore in
12.0.RC[34], but I never saw any replies (I suppose you were all busy
with other issues in the release candidates). Now when I try out 12.0.6
they still don't work like in (e.g.) 11.9.23. The structure isn't
translated and whether it's rotated I can't tell. Are the command(s)
changed in any way? I can't tell from the documentation that they are.
This is a snippet from my script that loads the pdb files and does the
rotation and translation:
appendNew = true
load 2oc5.pdb
load append 1w68.pdb
select :A/2
# 2oc5A - 1w68A (note that the line is continued; I've inserted the
# backslashes in the mail
r = [[ -0.59598154055, -0.32209352896, -0.73556900555 ], [ \
0.21345024134, -0.94661804765, 0.24156420749 ], [ -0.774109164, \
-0.013039573237, 0.63291782384 ]]
rq = quaternion(r)
t = { 174.54968533, 75.782173371, 65.591095934 }
rotateSelected MOLECULAR @rq
translateSelected @t
/Daniel
--
Daniel Lundin
Department of Molecular Biology & Functional Genomics
Arrhenius Laboratories for Natural Sciences
Stockholm University, SE-106 91 Stockholm, Sweden
tel. +46 (0)8 16 41 95, mobile: +46 (0)708 123 922, fax. +46 (0)8 16 64 88
Email: [email protected]
------------------------------------------------------------------------------
This SF.net email is sponsored by
Make an app they can't live without
Enter the BlackBerry Developer Challenge
http://p.sf.net/sfu/RIM-dev2dev
_______________________________________________
Jmol-users mailing list
[email protected]
https://lists.sourceforge.net/lists/listinfo/jmol-users
