Re: [Jmol-developers] current work

2010-09-17 Thread Egon Willighagen
On Wed, Sep 15, 2010 at 7:38 PM, Jonathan Gutow gu...@uwosh.edu wrote: On Sep 15, 2010, at 10:41 AM, Robert Hanson wrote: -- proposing a NEW DEFAULT for Jmol for 12.1 and 12.0:       double bonds in the plane of the atoms, not twisty with orientation. This is the default I always expected,

[Jmol-developers] supercell option

2010-09-17 Thread P . Canepa
Dear all, could be possible to add an option to re-set the dimensions of the cell once you the original cell is manipulated? For instance load { 2 2 2} ; the command could be setSupercell ? So then when the structure is esported both the coordinate and the cell parameters are correctely

Re: [Jmol-developers] current work/double bond view...

2010-09-17 Thread Jonathan Gutow
I've played with Bob's example and here is my opinion. Before I used Jmol I thought the default should be double bonds all in one plane, but now feel that Jmol's present default where you see the double bonds no matter what the viewing angle is better. I do think the scale of the double

[Jmol-developers] [ jmol-Bugs-3066682 ] Bug in secondary prediction

2010-09-17 Thread SourceForge.net
Bugs item #3066682, was opened at 2010-09-15 10:48 Message generated for change (Comment added) made by lili35 You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=379133aid=3066682group_id=23629 Please note that this message will contain a full copy of the comment

Re: [Jmol-developers] supercell option

2010-09-17 Thread Robert Hanson
load {2 2 2} works just fine, right? Bob On Fri, Sep 17, 2010 at 2:04 AM, P.Canepa pc...@kent.ac.uk wrote: Dear all, could be possible to add an option to re-set the dimensions of the cell once you the original cell is manipulated? For instance load { 2 2 2} ; the command could be

[Jmol-developers] [ jmol-Bugs-3066682 ] Bug in secondary prediction

2010-09-17 Thread SourceForge.net
Bugs item #3066682, was opened at 2010-09-15 03:48 Message generated for change (Comment added) made by hansonr You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=379133aid=3066682group_id=23629 Please note that this message will contain a full copy of the comment

[Jmol-developers] [ jmol-Bugs-3066682 ] Bug in secondary prediction

2010-09-17 Thread SourceForge.net
Bugs item #3066682, was opened at 2010-09-15 03:48 Message generated for change (Comment added) made by hansonr You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=379133aid=3066682group_id=23629 Please note that this message will contain a full copy of the comment

[Jmol-developers] [ jmol-Bugs-3066682 ] Bug in secondary prediction

2010-09-17 Thread SourceForge.net
Bugs item #3066682, was opened at 2010-09-15 03:48 Message generated for change (Comment added) made by hansonr You can respond by visiting: https://sourceforge.net/tracker/?func=detailatid=379133aid=3066682group_id=23629 Please note that this message will contain a full copy of the comment