Re: [PyMOL] Using PyMol as a library - no GUI

2003-10-17 Thread Truls A. Tangstad
On Fri, Oct 17, 2003 at 09:41:24AM -0700, Warren L. DeLano wrote: > > Truls A. Tangstad wrote: > > I'm very interested in using alot of the functionality that PyMol > > offers programmatically from Python, i.e. without using a GUI at > > all. The chempy package seems to cover alot of my needs, load

Re: [PyMOL] Segment Identifiers

2003-10-17 Thread Jonathan Ostrem
How do I know what the segids are? How do I create segids? Thanks, Jon - Original Message - From: "Nat Echols" To: "Jonathan Ostrem" Cc: "PyMol User Group" Sent: Friday, October 17, 2003 12:08 AM Subject: Re: [PyMOL] Segment Identifiers > > if 'foo' is the segid of your kinase, > >

[PyMOL] new error

2003-10-17 Thread Tom Thompson
I just started to get this error mac-osx 10.2.6. Could it be correlated with a recent installation of the python-based molecular visualization programs from the MGL at Scripps. I have reinstalled the program and I get the same error. Traceback (most recent call last): File "/Applications/P

RE: [PyMOL] recommendations for G5

2003-10-17 Thread Warren L. DeLano
Wataru, I would tend to go with the 9800 if cost is not an issue -- it is a faster card than the 9600. Both work great with flat panels (though you'll need a CRT for stereo). Also, I've found that the 9600 does not support antialiased lines on the G5, much to my disappointment. I do now know wh

RE: [PyMOL] Using PyMol as a library - no GUI

2003-10-17 Thread Warren L. DeLano
If you've got PyMOL configured to open on import pymol pymol.finish_launching() You can suppress the GUI feature and suppress startup output by providing command line arguments as follows. Before importing PyMOL, set a "pymol_argv" list in the __main__ namespace. PyMOL will interpret this as a

[PyMOL] Using PyMol as a library - no GUI

2003-10-17 Thread Truls A. Tangstad
I'm very interested in using alot of the functionality that PyMol offers programmatically from Python, i.e. without using a GUI at all. The chempy package seems to cover alot of my needs, loading different file formats etc. even though it doesn't seem to be documented. Is it also possible to use t

[PyMOL] recommendations for G5

2003-10-17 Thread wkagawa
Dear staff (and pymol users): I am looking for some suggestions on the power mac G5 hardware to run pymol and other 3D applications without problems. Between the two graphic cards offered by Apple (ATI Radeon 9600 pro or 9800 pro), which do you recommend? Is it too risky to buy the 9800 pro b

Re: [PyMOL] Segment Identifiers

2003-10-17 Thread Nat Echols
if 'foo' is the segid of your kinase, PyMOL> select kinase, segi foo PyMOL> color green, segi foo it doesn't seem to care about any leading or lagging spaces, as far as I can tell. On Thu, 16 Oct 2003, Jonathan Ostrem wrote: > How are segment identifiers used. I have a PDB file with a kinase