Bugs item #1582461, was opened at 2006-10-22 12:52 Message generated for change (Comment added) made by hansonr You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=379133&aid=1582461&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: File Input/Output >Group: v11 >Status: Closed >Resolution: Fixed Priority: 5 Submitted By: David Evans (daevans) >Assigned to: Bob Hanson (hansonr) Summary: Multi-conformer sd file reading not working Initial Comment: When reading in multi-structure SD files, only one structure is stored. So it is not possible to use SD files for multiple-frame work. XYZ files work OK. Attached is an example multi sdf file which has three frames. (The frames are identical in this case, but it's just an example). This bug applies to v 10.9.80 and all previous versions which I have tried. Thanks, Dave ---------------------------------------------------------------------- >Comment By: Bob Hanson (hansonr) Date: 2006-10-22 14:21 Message: Logged In: YES user_id=1082841 Thanks for that file; we hadn't seen these before. This is done. Note that you can selectively add a specific model of the set. For example: load myfile.sdf 3 loads just the third model of the set contained in myfile.sdf ---------------------------------------------------------------------- You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=379133&aid=1582461&group_id=23629 ------------------------------------------------------------------------- Using Tomcat but need to do more? Need to support web services, security? Get stuff done quickly with pre-integrated technology to make your job easier Download IBM WebSphere Application Server v.1.0.1 based on Apache Geronimo http://sel.as-us.falkag.net/sel?cmd=lnk&kid=120709&bid=263057&dat=121642 _______________________________________________ Jmol-developers mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/jmol-developers
