From: Nick G. <ngr...@li...> - 2007-04-01 18:45:49
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Hi Karl, I use the Mac version of Spartan 04 to export collections of files as multiple-xyz files. The option is semi-hidden. You have to hold down option(Alt) while selecting Export to get the xyz(Jmol) option and I don't know if the Windows version has this option (I requested it for Mac OS). Another Mac application MacMolPlt http://www.scl.ameslab.gov/~brett/ MacMolPlt/ is also capable of exporting xyz files suitable for Jmol. I use gamess to generate the input in this case but I expect MacMolPlt can read other formats. All the best Nick -- WWW Pages: http://www.liv.ac.uk/Chemistrywww/Staff/greeves.html Tel: +44 (0)151-794-3506 (3500 secretary) On 31 Mar 2007, at 22:55, jmo...@li... wrote: > Message: 1 > Date: Tue, 27 Mar 2007 22:52:18 +0100 > From: Karl Harrison <kar...@ch...> > Subject: [Jmol-users] Animation Help > To: jmo...@li... > Cc: Karl Harrison <kar...@ch...> > Message-ID: <3EF...@ch...> > Content-Type: text/plain; charset=US-ASCII; delsp=yes; format=flowed > > Dear All, > > I've been asked to make some animation sequences for a science museum > exhibit. > > But am a bit stuck on how I can generate suitable .xyz or multi- > model .pdb files. > > I had hoped to use Cambridgesoft Chem 3D to construct the animation > sequence. Which I can do happily. > > But cannot get a suitable the Jmol will read to display as an > animation. > > Chem 3D will only save in three format which support mulitiple > frames, "Cart Coord 1", "Cart Coord 2", "MOPAC .mop" > > I can provide samples of these file formats (if any one is > interested). > > What do others use to generate their animation sequences ? Is MDL > Sculpt the only option. > > Looking forward to any help. > > Regards, Karl |