Re: [PyMOL] PyMOL 1.5 release

2011-11-21 Thread Donnie Berkholz
On 15:47 Thu 10 Nov , Jason Vertrees wrote: > As has always been the case, some new features added to Incentive > PyMOL v1.5.0 will not be immediately added to the open-source project, > as Incentive subscribers pay to have priority access to these new > features. I always wonder, are there

Re: [PyMOL] pymol autodock plugins

2011-05-02 Thread Donnie Berkholz
On 21:37 Thu 28 Apr , lina wrote: > Error: 1 > Exception in Tk callback > Function: > (type: 'instancemethod'>) > Args: () > Traceback (innermost last): > File "/usr/lib/python2.6/dist-packages/Pmw/Pmw_1_3/lib/PmwBase.py", > line 1747, in __call__ > return apply(self.func, args) >

Re: [PyMOL] [PYMOL] Autodock/Vina Plugin and MacPymol v.1.3 problem

2010-10-14 Thread Donnie Berkholz
On 17:39 Tue 12 Oct , Cristina Rodríguez wrote: > All it's alright! It gives me the right outputs, but when I want to > visualize them in the "View Pose" window, I can't load anything! I've > tried with *.pdbqt and *.dlg files obtained from Autock/Vina and > Autodock4 respectively. Is it po

Re: [PyMOL] Problem Compiling Pymol 1.2.x

2009-11-20 Thread Donnie Berkholz
On 13:38 Fri 20 Nov , Stephen P. Molnar wrote: > I had successfully compiled Plymol from the Subversion repository in > OpenSuSE v103. Linux. > > I say successfully, because I have just upgraded my linux computer to > OpenSuSE v11.2. Unfortunaltely, I have a bit of a problem compiling the > s

[PyMOL] Light sources not changing

2009-10-13 Thread Donnie Berkholz
Hi all, I'm trying to get the light sources to look a certain way for a raytraced image. When I go into the settings via "Edit All" and search for "light", I see 9 light sources. I tried to rearrange the ordering by just copying and pasting them around then hitting return, but it didn't seem t

Re: [PyMOL] Comparing B-factors of aligned residues

2009-07-12 Thread Donnie Berkholz
tion scores into the B-factor field using ConSurf, then comparing two homologs to look at gain-of-function and loss-of-function overlaid as color on a single structure. Bright red or blue indicate the most interesting differences. -- Thanks, Donnie Donnie Berkholz P. Andrew Karplus lab Oregon S

Re: [PyMOL] Comparing B-factors of aligned residues

2009-07-12 Thread Donnie Berkholz
On 10:11 Sun 12 Jul , Jason Vertrees wrote: > Donnie Berkholz wrote: > > I'm trying to compare the B-factors in two homologous proteins I > > aligned using 'super'. I can create an alignment object mapping > > residue pairs together, so I think what I wan

[PyMOL] Comparing B-factors of aligned residues

2009-07-11 Thread Donnie Berkholz
two CA B's onto one of the structures, then color it by B-factor and color unaligned residues gray. I can't even figure out how to get at the alignment object or what's in it, much less how to do this. Could anyone help me? -- Thanks, Donnie Donnie Berkholz P. Andrew

Re: [PyMOL] Homology Modeling in Pymol

2009-07-09 Thread Donnie Berkholz
On 21:38 Thu 09 Jul , Donnie Berkholz wrote: > On 17:24 Tue 30 Jun , Buz Barstow wrote: > > I have a very large library (almost 1000) of similar genetic > > sequences, for which I would like to generate homology models. Does > > anyone know of a way to automate r

Re: [PyMOL] Homology Modeling in Pymol

2009-07-09 Thread Donnie Berkholz
gh pymol, or alternatively through > python? There's a framework called Biskit that you can use to do it all locally. -- Thanks, Donnie Donnie Berkholz P. Andrew Karplus lab Oregon State University -- Enter the

Re: [PyMOL] The List Archive is Back!

2009-05-28 Thread Donnie Berkholz
archive/forum.php?forum_name=pymol-users> -- Thanks, Donnie Donnie Berkholz P. Andrew Karplus lab Oregon State University pgpvigVU2y0b8.pgp Description: PGP signature -- Register Now for Creativity and Technology (CaT), Ju

Re: [PyMOL] Caution - 120 Hz LCDs: Not CRT killers yet...

2009-02-10 Thread Donnie Berkholz
se all of the parts of them in some sort of Frankenstein setup pending support for LCD stereo. -- Thanks, Donnie Donnie Berkholz Developer, Gentoo Linux Blog: http://dberkholz.wordpress.com pgpn9D1b93hj3.pgp Description: PGP signature

Re: [PyMOL] Showing conserved residues

2009-01-30 Thread Donnie Berkholz
DB with a conservation index in the B-factor field. You can then load that into PyMol and color by B as usual. Since it's unclear exactly what you intend to do with this, I can't tell you whether ConSurf makes sense for your use. -- Thanks, Donnie Donnie Berkholz Developer, Gent

Re: [PyMOL] Caution - 120 Hz LCDs: Not CRT killers yet...

2009-01-23 Thread Donnie Berkholz
rce I found of that report: "Quad Buffered Stereo will be supported with the NVIDIA GeForce 3D vision glasses in upcoming driver release by spring 2009." <http://www.nvidia.com/object/quadro_stereo_technology.html> -- Thanks, Donnie Donnie Berkholz Developer, Gentoo Li

Re: [PyMOL] Problems with space group recognition

2008-01-12 Thread Donnie Berkholz
On 11:28 Sat 12 Jan , DeLano Scientific wrote: > > Output: > > 'ObjectMolecule: Read crystal symmetry information. > > Symmetry-Error: Urecognized space group symbol 'C 1 2 1'. > > Symmetry-Error: Unable to get matrices from sglite. > > CmdLoad: "pdb/1f5n.pdb" loaded as "1f5n".' > > > > I'm us

Re: [PyMOL] freeglut problem

2006-11-03 Thread Donnie Berkholz
DeLano Scientific wrote: > I believe Donnie is mistaken: PyMOL runs just fine with FreeGLUT 2.4.0 > (don't know about all 2.4.x though). Lack of an ability to create a direct > rendering context is most likely a problem with your graphics driver, X11 > configuration, pixel depth, or with the inte

Re: [PyMOL] freeglut problem

2006-11-02 Thread Donnie Berkholz
Hugo Gutiérrez de Teran wrote: > freeglut (/home/hteran/tmp/programs/pymol/pymol.exe): Unable to create > direct context rendering for window 'PyMOL Viewer' This may hurt > performance. > > But my system says I have freeglut installed: > > # yum search glut > freeglut.i386

Re: [PyMOL] undefined symbol: ObjectGroupAsPyList

2006-10-24 Thread Donnie Berkholz
DeLano Scientific wrote: > Donnie, > > Hmm...it seems "ObjectGroup.c" was left out of setup.py. It should be fixed > now. > > Thanks for the reminder! Thanks much! I really appreciate your quick response. Thanks again, Donnie signature.asc Description: OpenPGP digital signature

[PyMOL] undefined symbol: ObjectGroupAsPyList

2006-10-24 Thread Donnie Berkholz
I've been unable to start PyMOL from recent subversion builds. It worked in r2738 but fails in 2740 and newer (possibly 2739 as well, didn't check). Here's what I get: Traceback (most recent call last): File "/usr/lib/python2.4/site-packages/pymol/__init__.py", line 109, in ? import pymol

Re: [PyMOL] translating labels in space/overlayed labels

2006-09-22 Thread Donnie Berkholz
Younes wrote: > (1) I have tried following Warren's procedure to position labels in space: > > http://www.dl.ac.uk/list-archive-public/ccp4bb/2006-01/msg00695.html > > The following step did not seem to work: > > "then ctrl-middle-click-and-drag to position the label in space" > > I am using Py

Re: [PyMOL] Help for X.org-based Stereo 3D on Linux?

2006-09-06 Thread Donnie Berkholz
DeLano Scientific wrote: > PyMOL Users, > > We have gotten a couple of questions recently regarding running nVidia-based > Stereo 3D under the "X.org" X-server instead of using XFree86. > > We don't have X.org set up in house yet, so I was hoping someone else might > be able to provide a defini