[PyMOL] Creation of single nmr-like structure from separate pdb's

2012-07-20 Thread James Starlight
Dear PyMol users! I have big pdb ensembles consisted of 20-100 X-ray structures of different conformers of common protein solved by X-ray. I want to obtain single pdb files for such ensembles in NMR-like format. Firstly I can load all that pdbs into pymol by means of loadDir script. Now I'd

Re: [PyMOL] Creation of single nmr-like structure from separate pdb's

2012-07-20 Thread Thomas Holder
Hi James, are these structures identical in topology (same identifiers, no missing atoms)? If yes, just load them all into the same object: python import glob for filename in glob.glob('*.pdb'): cmd.load(filename, 'ensemble') python end If there are missing atoms or identifier mismatches,