Hi, I've been trying to get PyMOL to display a double bond at the position of the vinyl in the attached, small-moleculePDB for some time. The PDB was generated by converting a smiles representation of isopentenly diphosphate (obtained from PubChem) using Corina. The number of attached atoms at the vinyl group is correct, but PyMOL doesn't display the double bond. Cycling the bond valence produces a single-bond version (with added protons), but stops there - it won't cycle through triple, double, single. Downloaded a PDB of fumarate that does display double bonds in response to Set Valence - so, my version of PyMOL (1.1beta2, Vista environment) seems fine.
Thoughts? Thanks, Tom
BEGIN:VCARD VERSION:2.1 N:Leyh;Thomas;S.;Ph.D FN:Thomas S. Leyh ORG:AECOM;Biochemistry TEL;WORK;VOICE:718-430-2857 TEL;WORK;FAX:718-430-8565 ADR;WORK;ENCODING=QUOTED-PRINTABLE:;;Rm. 305 Forchh. Bldg.=0D=0A1300 Morris Park Ave.;Bronx;NY;10461 LABEL;WORK;ENCODING=QUOTED-PRINTABLE:Rm. 305 Forchh. Bldg.=0D=0A1300 Morris Park Ave.=0D=0ABronx, NY 10461 EMAIL;PREF;INTERNET:l...@aecom.yu.edu REV:20090514T171123Z END:VCARD
isopentenly diphosphate.pse
Description: Binary data
------------------------------------------------------------------------------ The NEW KODAK i700 Series Scanners deliver under ANY circumstances! Your production scanning environment may not be a perfect world - but thanks to Kodak, there's a perfect scanner to get the job done! With the NEW KODAK i700 Series Scanner you'll get full speed at 300 dpi even with all image processing features enabled. http://p.sf.net/sfu/kodak-com
_______________________________________________ PyMOL-users mailing list PyMOL-users@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/pymol-users