Hi Marcus,
Really great to hear that avogadro2 is now on the scene and I'm excited to
see how it develops in the future.
It's already looking very impressive - I read in some pretty big molecules
and the performance and responsiveness was incredibly snappy.
Where's the place to log bug reports while it's still in the initial
testing phase? I found one (see below) but it wasn't immediately obvious on
the openchemistry website where the tracker was.
Best wishes,
Jens
Bugs:
1.
draw C atom, click Extensions -> Open Babel -> Add Hydrogens:
Command-line output:
OBProcess::executeObabel: Running
"/Volumes/Avogadro2-0.5.0-Darwin/Avogadro2.app/Contents/MacOS/obabel"
"-icml -ocml -h"
"/Volumes/Avogadro2-0.5.0-Darwin/Avogadro2.app/Contents/MacOS/obabel"
stderr:
"==============================
*** Open Babel Error in RegisterOptionParam
The number of parameters needed by option "t" in The LPMD file format.
differs from an earlier registration.
0 molecules converted
"
Bad CML: ""
On 11 April 2013 19:54, Marcus D. Hanwell <marcus.hanw...@kitware.com>wrote:
> Hi,
>
> I wanted to let people on these lists know that we just made our first
> beta release of Avogadro 2, along with MoleQueue and MongoChem. Please
> see the blog post here,
>
> http://blog.cryos.org/archives/265-First-Open-Chemistry-Beta-Release.html
>
> We have created binary installers for Windows and Mac OS X, along with
> regular source releases,
>
> http://www.openchemistry.org/OpenChemistry/resources/software.html
>
> These are not feature complete, and we intend to make regular releases
> as new features land in master. There are several exciting new
> features, along with some missing pieces that will be brought back as
> we can get to them. I will work on making a screen cast highlighting
> how the three applications can be used together soon, and discussing
> some of the new features in more detail.
>
> We have automated as much of the testing and release process as
> possible, and will continue to streamline things. Binaries are
> uploaded nightly to the dashboards for Windows and Mac, and API
> documentation is updated nightly,
>
> http://cdash.openchemistry.org/
> http://doc.openchemistry.org/avogadrolibs/api/
>
> Avogadro 2 also uses a different binary name, and library names,
> meaning that there should be no problems in installing Avogadro 1 and
> 2 on the same system in the same prefixes. There is lots more to do
> before, so I will get back to it, but I hope you will check out what
> we have been working on. I will see if I can get some more of the
> features you have grown to expect back in Avogadro 2.
>
> Thanks,
>
> Marcus
>
>
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