Re: [PyMOL] Scripting in Pymol (+)

2016-07-13 Thread Sampson, Jared M.
Hi James - For the first part, you should use split_states and super or cealign, as in my response to one of your emails last month. https://sourceforge.net/p/pymol/mailman/message/35156097/ Then, once you have aligned all the trajectory structures (let's say they're called traj_01 through tra

[PyMOL] Scripting in Pymol (+)

2016-07-12 Thread James Starlight
Dear Pymol Users! Here I desice to continue my topic regarding scripting in Pymol; My current task: I have 1 X-ray structure of cythochrome-C with HEME residue embedded within the protein as a cofactor I have 10 snapshots of cythochrome-C from MD trajectory where HEME was not present explicitly