From: Robert H. <ha...@st...> - 2011-01-12 18:32:16
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not so new -- load xxxx.pdb filter "biomolecule 1" for example -- is that what you mean? On Wed, Jan 12, 2011 at 11:49 AM, Rolf Huehne <rh...@fl...>wrote: > On 01/03/2011 09:28 PM, Robert Hanson wrote: > > Angel's probably got the best idea. You can do that by using the extended > > select command: > > > > select {*.ca} (resno % 2 == 0) > > > > for example. That is, you can do any math you want on any atom property > by > > including it in parentheses after the selection in braces. But whether or > > not you can connect them.... I guess they are in order in the file. Maybe > > it's simplest just to do a FOR loop. > > > Did I miss a new option to apply the biomolecule symmetry operations > after loading a PDB file? > > Or would it still be necessary to produce a new file (or maybe string > for 'load inline') with the reduced atom set to be able to build the > biomolecule? > > Regards, > Rolf > > > ------------------------------------------------------------------------------ > Protect Your Site and Customers from Malware Attacks > Learn about various malware tactics and how to avoid them. Understand > malware threats, the impact they can have on your business, and how you > can protect your company and customers by using code signing. > http://p.sf.net/sfu/oracle-sfdevnl > _______________________________________________ > Jmol-users mailing list > Jmo...@li... > https://lists.sourceforge.net/lists/listinfo/jmol-users > -- Robert M. Hanson Professor of Chemistry St. Olaf College 1520 St. Olaf Ave. Northfield, MN 55057 http://www.stolaf.edu/people/hansonr phone: 507-786-3107 If nature does not answer first what we want, it is better to take what answer we get. -- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900 |