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Avogadro-1.0 and Eigen2/3


#1

Hi,

Avogadro-1.0 appears to be one of the last package still using the
Eigen2 interface (which we switched it to Eigen3 with -DEIGEN2_SUPPORT a
while ago), and which will be removed in Eigen 3.3, see bug
https://bugs.debian.org/786355

Will there be a Avogadro-1.0.4 release with a backported Eigen3
interface at some point?

Or will there be a stable Avogadro-1.2 at some point?

Michael


#2

Or will there be a stable Avogadro-1.2 at some point?

As soon as a Gaussian vs. Orca normalization bug is fixed, I will be releasing 1.2.0:

-Geoff


#3

Hi,

On Sat, Sep 26, 2015 at 09:57:22AM -0400, Geoffrey Hutchison wrote:

Or will there be a stable Avogadro-1.2 at some point?

As soon as a Gaussian vs. Orca normalization bug is fixed, I will be releasing 1.2.0:
https://github.com/cryos/avogadro/pull/31

Great!

Also, Anton Gladky has since updated our Eigen3 patch to drop
EIGEN2_SUPPORT and port the 1.0 codebase to Eigen3:

http://anonscm.debian.org/viewvc/debichem/unstable/avogadro/debian/patches/eigen3.patch?revision=5910&view=markup

Michael


#4

Also, Anton Gladky has since updated our Eigen3 patch to drop
EIGEN2_SUPPORT and port the 1.0 codebase to Eigen3:

Great, that’s very helpful. I’ll take a look later today.

-Geoff