Re: [PyMOL] Save list from external gui to file

2012-04-16 Thread Thomas Holder
Hi Mike, your script writes to standard output. Most likely it's easy to modify your script to write to a file instead, but you need basic python skills. If you don't manage yourself, feel free to send me the script. Cheers, Thomas On 04/16/2012 04:22 AM, Michael Osborne wrote: HI

Re: [PyMOL] Polar interactions within selection

2012-04-16 Thread Thomas Holder
Hi James, maybe something like this could help. It finds contacts between charged sidechains and prints the number of contacts in each state (requires get_raw_distances from [1] or [2]). # region of interest select roi, chain A # charged