Re: [PyMOL] Distance measure between pseudo atoms does not update over states

2023-07-19 Thread Istvan Kolossvary
Hi Jarrett, Thank you very much for the fix, it works perfectly. Best regards, Istvan On Wed, Jul 19, 2023 at 9:02 PM Jarrett Johnson < jarrett.john...@schrodinger.com> wrote: > Hi Istvan, > > I can reproduce the same issue. Seems to be some unintended behavior with > how this multistate p

Re: [PyMOL] Question on residue selection in multiple PDB

2023-07-19 Thread Neena Susan Eappen
Hello PyMOL users, Can I get some insight on how to approach this analysis? Many thanks, Neena On Wed, 5 Jul 2023 at 18:54, Neena Susan Eappen wrote: > Hello PyMOL Team, > > I am studying a protein called Trp-cage (PDB code: 1L2Y); this PDB has 38 > NMR structures deposited in it. > Using spli

Re: [PyMOL] Distance measure between pseudo atoms does not update over states

2023-07-19 Thread Jarrett Johnson
Hi Istvan, I can reproduce the same issue. Seems to be some unintended behavior with how this multistate pseudoatom object is created. I've attached a modified center_of_mass.py script so that it should behave the way you expect. Let me know if this works for you. Example that I tried with this: