Re: [PyMOL] Select crystal waters inside protein

2012-07-02 Thread Thomas Holder
Hi James, the beyond operator yields true only if the considered atom pair distance is beyond the threshold in ALL states. To remove atoms which are beyond threshold in ANY state, try this: python for i in range(cmd.count_states()): cmd.select('tmp', 'solvent beyond 5 of polymer',

Re: [PyMOL] O1P versus OP1

2012-07-02 Thread Thomas Holder
Hi Pascal, I don't think that PyMOL has an automatic renaming mode for those names. But you can rename them manually: alter name O1P, name=OP1 alter name O2P, name=OP2 http://pymolwiki.org/index.php/Alter Cheers, Thomas Pascal Auffinger wrote, On 06/27/12 19:13: Hi, What is the