Re: [PyMOL] Clashes cut off

2012-05-21 Thread Thomas Holder
Hi Doran, this is a python script, so you must load it with "run". http://www.pymolwiki.org/index.php/Running_Scripts Use the "get" command to query default values of settings: PyMOL>get sculpt_vdw_vis_max get: sculpt_vdw_vis_max = 0.3 So the complete procedure should look like this: ru

Re: [PyMOL] Clashes cut off

2012-05-21 Thread doranhen
Hi Thomas, Thank you for your reply. I tried running the show_bumps.py script I copied from PymolWiki using @,however pymol gives me the following error : NameError: name 'show_bumps' is not defined How can I define it? Also, do you know what are the values that sculpt_vdw_vis_max, mid and min

Re: [PyMOL] Clashes cut off

2012-05-21 Thread Thomas Holder
Hi Arne, this works for any kind of molecule. Cheers, Thomas Arne Dieckmann wrote, On 05/20/12 22:56: > Hi Thomas, > > is this a general purpose script or does it only work for proteins/amino > acids? > > > Cheers, > Arne > > - - - - - - - - - - - - - - - - - - - - - - - - - - - - - -

Re: [PyMOL] Clashes cut off

2012-05-20 Thread Arne Dieckmann
Hi Thomas, is this a general purpose script or does it only work for proteins/amino acids? Cheers, Arne - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - Dr. Arne Dieckmann Houk Research Lab | University of California, Los Angeles On May 20,

Re: [PyMOL] Clashes cut off

2012-05-20 Thread Thomas Holder
Hi Doran, there is a script on the PyMOLWiki that shows VDW clashes: http://pymolwiki.org/index.php/Show_bumps There are several sculpt_vdw_vis_* settings which control the visualization: sculpt_vdw_vis_max sculpt_vdw_vis_mid sculpt_vdw_vis_min Cheers, Thomas doran...@post.tau.ac.il wrote,