[Jmol-users] Picking and measuring

G'day, When the "picking" mode is one of distance, angle or torsion would it be possible to have measurement rendered on the structure (rather than just echoed to the console) both during and at the completion of the pick? A fe

Re: [Jmol-users] Help on vibrations needed

2. -my biggest problem: I had my output from another MD-program converted into something similar to a g98 file, and it worked nicely with jmol9, including the vibrations, but now with jmol10 it fails to load in both the application and the applet. So, what is the minimum requirement for a gau

Re: [Jmol-users] Help on vibrations needed

Uwe wrote: > Hmmm, I still don't understand that. So what is missing in this file ? You just need to display a higher model number. load samples/gaussian/ch3oh_g94.out; model 9; vibration on; > That's a pity for me, now I have to rework my files. Is there any > documentation which informations a

Re: [Jmol-users] Help on vibrations needed

Thanks for the help so far, but ... On 14. Mar 2005, at 15:26 Uhr, Miguel wrote: I suspect your problem is ... The problem is that Gaussian files contain multiple 'models'. We are now capturing all the models, inputs + calculated outputs. The input models do not contain force vectors, so there is n

Re: [Jmol-users] Help on vibrations needed

Uwe wrote: > > I've some problems to get vibrations animated with jmol10. > 1. In the applet I can load e.g. the sample file from jmol9 ( > ch3oh_g94.out) file but I can't animate the vibrations. I suspect your problem is ... The problem is that Gaussian files contain multiple 'models'. We are

[Jmol-users] Help on vibrations needed

Hello, I've some problems to get vibrations animated with jmol10. 1. In the applet I can load e.g. the sample file from jmol9 ( ch3oh_g94.out) file but I can't animate the vibrations. I've looked at the demo script http://jmol.sourceforge.net/demo/vibration/ but I don't understand how to proper

Re: [Jmol-users] measurements + frames/models

Bob Hanson wrote: Miguel wrote: Q: Is it acceptable to say that an 'animation' is one where every frame has the same number of atoms in the same order? This sounds good to me. This is restrictive, I don't think it is necessary. Q: In this case, should measurements be automatically transferred fr

Re: [Jmol-users] Error when running jmol app

On Monday 14 March 2005 01:47 am, Brian Salter-Duke wrote: > I have got the jmol application working OK on a SGI, but I would like to > run it on my own linux box. When I type "./jmol" in the jmol directory, > it reports:- > > Warning: Major version number mismatch. > Warning: Minor version number