On 02/19/2010 06:20 AM, Otis Rothenberger wrote: > 1) The ridiculous addition of astatine relates to my inability to use > getProperty for the atomIndex of the newly appended atom, so I appended a > very rare element, selected it, and changed it to carbon. Is there a way to > get this atomIndex a bit more gracefully? > You could store all pre-existing atoms in a varaible and after the addition use this set to select only the new atom:
define old_atoms all ...add atom... select not old_atoms Regards, Rolf ------------------------------------------------------------------------------ Download Intel® Parallel Studio Eval Try the new software tools for yourself. Speed compiling, find bugs proactively, and fine-tune applications for parallel performance. See why Intel Parallel Studio got high marks during beta. http://p.sf.net/sfu/intel-sw-dev _______________________________________________ Jmol-users mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/jmol-users
