Hi Paul, I played with this for a while. Did Filter “2d” ever work with load data? I keep getting jmol script errors if I try to incorporate the filter. I tried several locations for insertion.
This alternative gets the job done: load DATA "model" Ethane http://www.ichemlabs.com 2 1 0 0 0 0 999 v2000 -0.4330 -0.2500 0.0000 C 0 0 0 0 0 0 0.4330 0.2500 0.0000 C 0 0 0 0 0 0 1 2 1 0 0 0 M END "model";calculate hydrogens;minimize Otis -- Otis Rothenberger o...@chemagic.com http://chemagic.com > On Sep 13, 2015, at 11:26 PM, Paul PILLOT <paulpil...@gmail.com> wrote: > > Hi Jmolers, > I’ve tried with the 2 latest versions of Jmol (14.3.16, 14.2.15) and they > both seem broken in respect with this command. > > Test case : > copy and paste the following in Jmol console : > > load DATA "model" > Ethane > > http://www.ichemlabs.com <http://www.ichemlabs.com/> > 2 1 0 0 0 0 999 v2000 > -0.4330 -0.2500 0.0000 C 0 0 0 0 0 0 > 0.4330 0.2500 0.0000 C 0 0 0 0 0 0 > 1 2 1 0 0 0 > M END "model" filter "2D" > > > It displays only 2 atoms of carbon instead of adding the required hydrogen > and minimizing. > > -Paul > ------------------------------------------------------------------------------ > _______________________________________________ > Jmol-users mailing list > Jmol-users@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/jmol-users
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