From: Bob H. <ha...@st...> - 2006-11-20 18:49:35
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Hmm. My tests suggest this works just fine. I wonder what the problem is. 24 Caffeine #jmolscript:moveto 1 -971 -203 125 86.4;background red; H -3.3804130 -1.1272367 0.5733036 N 0.9668296 -1.0737425 -0.8198227 C 0.0567293 0.8527195 0.3923156 N -1.3751742 -1.0212243 -0.0570552 C -1.2615018 0.2590713 0.5234135 C -0.3068337 -1.6836331 -0.7169344 C 1.1394235 0.1874122 -0.2700900 N 0.5602627 2.0839095 0.8251589 O -0.4926797 -2.8180554 -1.2094732 C -2.6328073 -1.7303959 -0.0060953 O -2.2301338 0.7988624 1.0899730 H 2.5496990 2.9734977 0.6229590 C 2.0527432 -1.7360887 -1.4931279 H -2.4807715 -2.7269528 0.4882631 H -3.0089039 -1.9025254 -1.0498023 H 2.9176101 -1.8481516 -0.7857866 H 2.3787863 -1.1211917 -2.3743655 H 1.7189877 -2.7489920 -1.8439205 C -0.1518450 3.0970046 1.5348347 C 1.8934096 2.1181245 0.4193193 N 2.2861252 0.9968439 -0.2440298 H -0.1687028 4.0436553 0.9301094 H 0.3535322 3.2979060 2.5177747 H -1.2074498 2.7537592 1.7203047 Angel Herraez wrote: >I have read several posts about the ability to use #jmolscript: for including scripts within a >molecular coordinate file, but cannot find any documentation. > >Apparently, line nr.2 in MOL files is the place for comments. Where should it go for an XYZ >file? Some doc I found on the web says on line 2, but Jmol does not seem to recognize it >either on lines 1 or 2. > > > > >------------------------------------------------------------------------- >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 > > |