From: Bob H. <ha...@st...> - 2006-09-23 11:52:42
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Thanks, Nico. The comment regarding save/restore selection is a bit vague. Here's a better one: save/restore selection ---------------------- Jmol 10.9.63 allows saving and restoring of the current selection set across file load boundaries. Note that this is slightly different from "define" because those selections are reset every time a model is loaded. save/restore selection should be used with care, because the list of atoms that are "carbon" for one molecule may not be the same as the list of atoms that are "carbon" for another, and only the list of atoms is saved, not the fact that they were carbons. For best results, limit the use of this command to situations where you are loading the same molecule -- using load "" -- not some other molecule, unless you have a good reason to do otherwise. load caffeine.xyz;selectionHalos on select _C; save selection X # now move the model around save orientation X load "";restore orientation X 1;restore selection X;selectionHalos on >save/restore selection >---------------------- > >Jmol 10.9.63 allows saving and restoring of the current selection set. >Note that this is quite different from "define" because it saves and restores the precise set of atoms currently selected, not *why* they were selected. > >load caffeine.xyz;selectionHalos on >select _C; save selection X ># now move the model around >save orientation X >load caffeine.xyz;restore orientation X 1;restore selection X;selectionHalos on > > >Bob Hanson > > > >------------------------------------------------------------------------- >Take Surveys. Earn Cash. Influence the Future of IT >Join SourceForge.net's Techsay panel and you'll get the chance to share your >opinions on IT & business topics through brief surveys -- and earn cash >http://www.techsay.com/default.php?page=join.php&p=sourceforge&CID=DEVDEV >_______________________________________________ >Jmol-users mailing list >Jmo...@li... >https://lists.sourceforge.net/lists/listinfo/jmol-users > > |