Re: [PyMOL] Fetch Command

2010-08-06 Thread David Hall
Looking at the code around fetch, it seems pymol makes an assumption that has annoyed me in many other pieces of software, that there is only one biological assembly in the pdb. Lots of proteins have 2 or more. I think I've even seen one with 6. The second biological assembly has an extension of

Re: [PyMOL] Fetch Command

2010-08-06 Thread Jason Vertrees
Hi David, You're right. It's fixed now. I'll check the code in later today. PyMOL understands the types better now and it even works across the wwPDB servers. The PDB id "3by0" is a good test case; it has pdb, biounits and density data. Test out the new code with: # let's fetch from Nihon. se

Re: [PyMOL] Fetch Command

2010-08-06 Thread Andreas Forster
Fetching different biological units is cool. But can I query the pdb through PyMOL to see what biological units are associated with a pdb? (Could look it up directly, but I like one-stop shopping.) Thanks. Andreas On Fri, Aug 6, 2010 at 4:14 PM, Jason Vertrees wrote: > Hi David, > > You're

Re: [PyMOL] PyMol Connectivity Data

2010-08-06 Thread Martin Hediger
Hallo Thanks for the answer. So could PyMol generate the connectivity it sees? So this could be used for a subsequent force field computation? -- This SF.net email is sponsored by Make an app they can't live without En