Re: [PyMOL] Detecting holes/cavities in surface

2016-07-21 Thread Douglas Houston
Hi Daniel, If you don't HAVE to use Pymol, something like fPocket, HOLE or PocketDepth from this list might do what you want: http://www.vls3d.com/links/bioinformatics/binding-pockets You might find this list interesting too: http://www.vls3d.com/links/bioinformatics/peptides-antibodies-epito

Re: [PyMOL] Detecting holes/cavities in surface

2016-07-20 Thread Daniel James
Thank you for your responses guys. CAVER is another possible PyMOL plugin http://www.caver.cz Thanks Emilio. I have installed CAVER and I'm looking into it now - will let you know if this works well for me. Also thank you to Andreas and Doug. I'll be sure to check your suggestions out! It doesn

Re: [PyMOL] Detecting holes/cavities in surface

2016-07-20 Thread Emilio Xavier Esposito
Hi Daniel CAVER is another possible PyMOL plugin http://www.caver.cz >From the CAVER website, "CAVER provides rapid, accurate and fully automated calculation of tunnels and channels in static and dynamic structures. The molecules amendable to analysis of CAVER include proteins, nucleic acids, or i

Re: [PyMOL] Detecting holes/cavities in surface

2016-07-19 Thread Andreas Warnecke
I haven't used it before, but I there is a PyMOL plugin called KVfinder that detects cavities. Potentially this offers an approach for you. On Jul 20, 2016 12:05 AM, "Daniel James" wrote: > Hi all, > > I haven't used this list before but can't find an answer to my question > elsewhere. I am selec