Re: [PyMOL] Retain order for select segment and write trajectory

2017-07-19 Thread Kelly Tran
umber which is beyond the atom count. > > set retain_order > alter solvent, rank= > sort > > The atom ID is never used for sorting. But you could incorporate it in the > ranks: > > set retain_order > alter solvent, rank= + ID > sort > > Cheers,

[PyMOL] Retain order for select segment and write trajectory

2017-07-18 Thread Kelly Tran
Hi, I'm using PSICO to write a DCD. Is it possible to retain the original order for one segment (protein) while sorting by atom ID for another segment (water). Thank you, Kelly -- Check out the vibrant tech community on