From: SourceForge.net <no...@so...> - 2010-12-01 02:46:12
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Bugs item #3124153, was opened at 2010-12-01 02:46 Message generated for change (Tracker Item Submitted) made by nobody You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=835077&aid=3124153&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 1.2.x Status: Open Resolution: None Priority: 5 Private: No Submitted By: Nobody/Anonymous (nobody) Assigned to: Nobody/Anonymous (nobody) Summary: Orbitals in nightly build atom indexing is wrong Initial Comment: Hi! I'm so excited to see GAMESS orbitals finally visualized YAY! It's great! Unfortunately there are a couple of bugs: 1) Most importantly, the orbital coefficients are not properly mapped (atoms get orbital coefficients from other atoms, so the orbitals look very wrong) 2) All orbitals load, and this is rather slow, also the load bar color on the current mac build is very light grey- hard to see Also, would be nice to see a SOMO if the molecule has a free spin. Great work guys and gals, thanks so much!!! ---------------------------------------------------------------------- You can respond by visiting: https://sourceforge.net/tracker/?func=detail&atid=835077&aid=3124153&group_id=165310 |