Bugs item #3406817, was opened at 2011-09-09 08:28 Message generated for change (Comment added) made by ghutchis You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=835077&aid=3406817&group_id=165310
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: Commands / Extensions Group: v 1.1.0 >Status: Closed Resolution: None Priority: 8 Private: No Submitted By: https://www.google.com/accounts () Assigned to: David Lonie (mr_grieves) Summary: crash with electrostatic potential of certain molecules Initial Comment: Hi. I have windows 7 Home edition and Avogadro 1.0.3. These are the steps to reproduce the crash: 1) Open Avogadro with an empty project 2) With the draw tool, select Chlorine, select the check box to add a hydrogen, click on an empty space to add a chlorine atom bonded with an hydrogen 3) ctrl+alt+o to optimize geometry (or select the appropriate function on the menu) 4) go to extentions->build surfaces Surface type: van der Waalls Colors for: Electrostatic potential Resolution: Medium ISO value: 0 (What's this? cannot find in the doc) In display type: surface 5) Select calculate 6) Avogadro will crash I have tried to compile avogadro on windows, have succed in the compilation with vc++ 2010 but failed to open avogadro: the resulted binary does nothing. So i cannot post a backtrace. ---------------------------------------------------------------------- >Comment By: Geoff Hutchison (ghutchis) Date: 2012-06-14 19:10 Message: This is fixed, in the sense that electrostatic potential surfaces themselves are not implemented and there's an open feature request. Instead, create a VdW surface and map the electrostatic potential. ---------------------------------------------------------------------- Comment By: Geoff Hutchison (ghutchis) Date: 2012-06-13 21:27 Message: I think this is fixed, can we confirm that? ---------------------------------------------------------------------- You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=835077&aid=3406817&group_id=165310 ------------------------------------------------------------------------------ Live Security Virtual Conference Exclusive live event will cover all the ways today's security and threat landscape has changed and how IT managers can respond. Discussions will include endpoint security, mobile security and the latest in malware threats. http://www.accelacomm.com/jaw/sfrnl04242012/114/50122263/ _______________________________________________ Avogadro-devel mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/avogadro-devel
