can you suggest from start to finish. Amitesh kumar sharma Noida Uttar Pradesh
On Tue, Aug 11, 2015 at 11:42 AM, Rolf Huehne <rhue...@fli-leibniz.de> wrote: > Am 11.08.15 um 03:00 schrieb Eric Martz: > > For every pair of altloc ids, I want a list of atoms (selectable and > > counted) that are present in one but absent in the other, and vice > > versa. I will attempt to develop a Jmol function to do this. I will ask > > for your help if (when?) I get stuck. > > > Eric, I have one one quick suggestion. > > Use two functions: the existing one and an outer function that builds > the pairs and collects the lists for each pair. > In the existing function you would just have to replace the 'select > result_list' command by 'return result_list'. > Then you could provide as 'atom_set' parameter a reduced altloc atom > list like this: > > atom_set_reduced = select(x; {@atom_set}; x.altloc=altloc_id_1 or > x.altloc=altloc_id_2); > > Regards, > Rolf > > > ------------------------------------------------------------------------------ > _______________________________________________ > Jmol-users mailing list > Jmol-users@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/jmol-users >
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