Re: [PyMOL] setting the cutoff radius that determines when atoms are bonded

2012-12-06 Thread Thomas Holder
Hi Rye, only discrete objects have per state bonding information. Try this: load multistate.pdb, discrete=1 Hope that helps. Cheers, Thomas Rye Terrell wrote, On 12/05/12 18:20: I'm loading a movie file now and it appears that the bonds determined in the first frame are used throughout

Re: [PyMOL] setting the cutoff radius that determines when atoms are bonded

2012-12-06 Thread Rye Terrell
Thanks Thomas. That may or may not have worked, I can't tell. Usually after I load the movie, I can hide all followed by show sticks, and this will show me sticks for all frames of the movie. When I do this now, I get sticks for the first frame, but nothing shows up on later frames. Even if I go

Re: [PyMOL] setting the cutoff radius that determines when atoms are bonded

2012-12-05 Thread Rye Terrell
I'm loading a movie file now and it appears that the bonds determined in the first frame are used throughout the entire movie, even if atoms move further apart than the cutoff. Is my perception correct here? If so, can I make the bonds be calculated for each frame? On Tue, Dec 4, 2012 at 11:43

Re: [PyMOL] setting the cutoff radius that determines when atoms are bonded

2012-12-04 Thread Rye Terrell
Hi Jason, Thanks for the tip. I still couldn't get it to work. I'll google around some more, but here's the file. Thanks for any help. Cheers, Rye On Mon, Dec 3, 2012 at 4:34 PM, Jason Vertrees jason.vertr...@schrodinger.com wrote: Hi Rye, How about connect_cutoff in Å? There's also

Re: [PyMOL] setting the cutoff radius that determines when atoms are bonded

2012-12-04 Thread Jason Vertrees
Hi Rye, set connect_cutoff, 0.5 load 1.xyz produces different bonding than if you left the connect_cutoff value to its default, 0.35. Set it to 0.85 and then load the file and you'll see the Unknown atoms in the middle bonded as well. Cheers, -- Jason On Tue, Dec 4, 2012 at 11:33 AM, Rye

Re: [PyMOL] setting the cutoff radius that determines when atoms are bonded

2012-12-04 Thread Rye Terrell
Not sure what I was doing wrong before, but that worked like a charm! Thanks. Also, pyMol is really sweet. I've been bugging my group to use it for a few days now. :D Cheers, Rye On Tue, Dec 4, 2012 at 11:40 AM, Jason Vertrees jason.vertr...@schrodinger.com wrote: Hi Rye, set

[PyMOL] setting the cutoff radius that determines when atoms are bonded

2012-12-03 Thread Rye Terrell
I have a silicon bulk system. Pymol indicates that a handful of the atoms are bonded to each other. Many bonds are not indicated. Is there some value I can adjust that will make pymol indicate that more atoms are bonded? I usually do this by setting some cutoff radius, but googling around has

Re: [PyMOL] setting the cutoff radius that determines when atoms are bonded

2012-12-03 Thread Jason Vertrees
Hi Rye, How about connect_cutoff in Å? There's also connect_mode (http://www.pymolwiki.org/index.php/Connect_mode). If you send me a copy of your file I can look at it. Cheers, -- Jason On Mon, Dec 3, 2012 at 4:03 PM, Rye Terrell ryeterr...@ryeterrell.net wrote: I have a silicon bulk system.