Re: [PyMOL] How to get TTT matrix in PyMOL 1.7.6?

2015-08-18 Thread Paweł Tomaszewski
Thanks Jared,
I have tried the transformations.py script, and here is what I've got:
- I get a quaternions from external source (a 3d manipulator) in a
classical form: [x,y,z,w]
- I use function: quaternion_matrix(quaternion) from transformations.py
script:

m = quaternion_matrix([x, y, z, w])# m is an array of an arrays (4x4)
M = [m[0,0], m[0,1], m[0,2], m[0,3], m[1,0], m[1,1], m[1,2], m[1,3],
m[2,0], m[2,1], m[2,2], m[2,3], m[3,0], m[3,1], m[3,2], m[3,3]]   # so i
need to convert it to a vector 16x1
cmd.transform_selection(all, M, homogenous=1)  # its time to apply the
vector into a transform_selection function; homogenous=0 also doesn't work
print M # print works fine ;)

But the function transform_selection does not work and I don't really know
why, rotation doesn't occur.
Maybe it's because the selection is wrong? On the scene I have a CGO (an
arrow) and even when I change the selection string from all to arrow it
doesn't rotate either.
What exactly is the selection, could this be a CGO?

I have also noticed, that function cmd.rotate(...) works for my CGO arrow
when I set property object=arrow and I put some arbitrary hardcoded
parameters (axis and angle).
Maybe the better way would be use this function?
But I'm not really sure which function from transformations.py script
should I use to convert quaternions to axis and angle params required by
cmd.rotate() function...
any ideas?

Cheers,
Pawel T.





2015-08-13 18:34 GMT+02:00 Sampson, Jared jared.samp...@nyumc.org:

 Hi Paweł -

 Honestly, if you prefer to use matrices, I'd say just go ahead and use
 get_object_matrix; I doubt it's going away any time soon.  You may want to
 use this in combination with transform_selection
 http://www.pymolwiki.org/index.php/Transform_selection.

 Also maybe check out Christoph Gohlke's transformations.py script
 http://www.pymolwiki.org/index.php/Transformations.  It offers several
 tools for manipulating quaternions, matrices, and angle/axis operations.  I
 think there's also a newer version on his website, which is linked from the
 wiki page.

 Cheers,
 Jared

 --
 Jared Sampson
 Xiangpeng Kong Lab
 NYU Langone Medical Center
 http://kong.med.nyu.edu/






 On Aug 6, 2015, at 4:04 AM, Paweł Tomaszewski croov...@gmail.com wrote:

 Hello,
 I've created a CGO in pymol script (a cone) and I need to make some
 transformations on it. I've found that it is easier for me to modify a TTT
 matrix rather than using translate/rotate functions.

 Documentation says [http://www.pymolwiki.org/index.php/Get_object_matrix]
 get_object_matrix is unsupported operation. So how to get/set TTT?

 The problem is, that I get (from external source) position in quaternions
 and now I need to make my CGO position equal to those quaternion. How can I
 make it work?

 Thanks
 Paweł Tomaszewski

 --
 ___
 PyMOL-users mailing list (PyMOL-users@lists.sourceforge.net)
 Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users
 Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net



 
 This email message, including any attachments, is for the sole use of the
 intended recipient(s) and may contain information that is proprietary,
 confidential, and exempt from disclosure under applicable law. Any
 unauthorized review, use, disclosure, or distribution is prohibited. If you
 have received this email in error please notify the sender by return email
 and delete the original message. Please note, the recipient should check
 this email and any attachments for the presence of viruses. The
 organization accepts no liability for any damage caused by any virus
 transmitted by this email.
 =

--
___
PyMOL-users mailing list (PyMOL-users@lists.sourceforge.net)
Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users
Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net

Re: [PyMOL] How to get TTT matrix in PyMOL 1.7.6?

2015-08-13 Thread Sampson, Jared
Hi Paweł -

Honestly, if you prefer to use matrices, I'd say just go ahead and use 
get_object_matrix; I doubt it's going away any time soon.  You may want to use 
this in combination with 
transform_selectionhttp://www.pymolwiki.org/index.php/Transform_selection.

Also maybe check out Christoph Gohlke's transformations.py 
scripthttp://www.pymolwiki.org/index.php/Transformations.  It offers several 
tools for manipulating quaternions, matrices, and angle/axis operations.  I 
think there's also a newer version on his website, which is linked from the 
wiki page.

Cheers,
Jared

--
Jared Sampson
Xiangpeng Kong Lab
NYU Langone Medical Center
http://kong.med.nyu.edu/






On Aug 6, 2015, at 4:04 AM, Paweł Tomaszewski 
croov...@gmail.commailto:croov...@gmail.com wrote:

Hello,
I've created a CGO in pymol script (a cone) and I need to make some 
transformations on it. I've found that it is easier for me to modify a TTT 
matrix rather than using translate/rotate functions.

Documentation says [http://www.pymolwiki.org/index.php/Get_object_matrix] 
get_object_matrix is unsupported operation. So how to get/set TTT?

The problem is, that I get (from external source) position in quaternions and 
now I need to make my CGO position equal to those quaternion. How can I make it 
work?

Thanks
Paweł Tomaszewski
--
___
PyMOL-users mailing list 
(PyMOL-users@lists.sourceforge.netmailto:PyMOL-users@lists.sourceforge.net)
Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users
Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net



This email message, including any attachments, is for the sole use of the 
intended recipient(s) and may contain information that is proprietary, 
confidential, and exempt from disclosure under applicable law. Any unauthorized 
review, use, disclosure, or distribution is prohibited. If you have received 
this email in error please notify the sender by return email and delete the 
original message. Please note, the recipient should check this email and any 
attachments for the presence of viruses. The organization accepts no liability 
for any damage caused by any virus transmitted by this email.
=
--
___
PyMOL-users mailing list (PyMOL-users@lists.sourceforge.net)
Info Page: https://lists.sourceforge.net/lists/listinfo/pymol-users
Archives: http://www.mail-archive.com/pymol-users@lists.sourceforge.net