On Tue, April 14, 2009 3:02 pm, [email protected] wrote: > Hello, > > I'm sure there's a really easy way to do this but as a new Jmol scripter > I'm struggling to see how! I need to write a Jmol script to select all > atoms with names ending in '?'. My input file is a CIF and the presence of > a trailing question mark in the atom name indicates a disordered atom, > e.g. 'C33?'.
Is this construct a legal CIF atom_site_label Ian? As far as I am aware the CIF dictionary doesn't allow for that type of label. Or is this just for in-house use? Rich ------------------------------------------------------------------------------ This SF.net email is sponsored by: High Quality Requirements in a Collaborative Environment. Download a free trial of Rational Requirements Composer Now! http://p.sf.net/sfu/www-ibm-com _______________________________________________ Jmol-users mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/jmol-users
