Feature Requests item #2861188, was opened at 2009-09-18 01:10 Message generated for change (Comment added) made by hansonr You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=379136&aid=2861188&group_id=23629
Please note that this message will contain a full copy of the comment thread, including the initial issue submission, for this request, not just the latest update. Category: Interface Improvements Group: None >Status: Closed Priority: 5 Private: No Submitted By: Jan Jensen (jhjensen2) Assigned to: Nobody/Anonymous (nobody) Summary: Superimposing frames by aligning 3 atoms Initial Comment: It would be very useful to be able to superimpose molecules (frames) with different number of atoms (frame align required identical molecular I believe). The easiet way should be the alignment of 3 user defined atoms in each molecule. ---------------------------------------------------------------------- >Comment By: Bob Hanson (hansonr) Date: 2010-03-25 16:53 Message: now possible using the COMPARE command. See Jmol 11.10 documentation. ---------------------------------------------------------------------- Comment By: Jan Jensen (jhjensen2) Date: 2009-09-20 10:49 Message: yes, exactly. One could translate so that the first atom pairs coincide. The rotate so the second atom pair is along the same line, then rotate again so the third atom pair is in the same plane. It would be great if it would also work for more than 2 frames. ---------------------------------------------------------------------- Comment By: Bob Hanson (hansonr) Date: 2009-09-19 13:25 Message: are you thinking that you want to do both translation and rotation in order to align the specified atoms most closely? ---------------------------------------------------------------------- You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=379136&aid=2861188&group_id=23629 ------------------------------------------------------------------------------ Download Intel® Parallel Studio Eval Try the new software tools for yourself. Speed compiling, find bugs proactively, and fine-tune applications for parallel performance. See why Intel Parallel Studio got high marks during beta. http://p.sf.net/sfu/intel-sw-dev _______________________________________________ Jmol-developers mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/jmol-developers
