Re: [Rdkit-discuss] [Rdkit-devel] Where's the 2018.03 release?

2018-04-04 Thread Maciek Wójcikowski
Hi Greg,

I don't know if it is of any help, but we have fixed recent conda (linking
against Python library) for OpenBabel by adding additional linker
parameters for Mac in cmake config, see Matts patch here:
https://github.com/openbabel/openbabel/pull/1807/files


Pozdrawiam,  |  Best regards,
Maciek Wójcikowski
mac...@wojcikowski.pl

2018-04-04 5:39 GMT+02:00 Greg Landrum :

> Dear all,
>
> As you may have noticed, the new release (2018.03) is late.
>
> This is not, as you might expect, connected to my previous email about the
> backend code changes. It turned out to be much more difficult than
> anticipated to straighten out the problems we were having with newer
> versions of conda, particularly on the Mac, and we didn't want to do a
> release until those were taken care of.
>
> It looks like we're almost there. Hopefully we will be able to do a beta
> of the 2018.03 release by the end of the week.
>
> Best,
> -greg
>
>
> 
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Re: [Rdkit-discuss] [Rdkit-devel] Where's the 2018.03 release?

2018-04-04 Thread Greg Landrum
On Wed, Apr 4, 2018 at 10:30 AM, Maciek Wójcikowski 
wrote:

>
> I don't know if it is of any help, but we have fixed recent conda (linking
> against Python library) for OpenBabel by adding additional linker
> parameters for Mac in cmake config, see Matts patch here:
> https://github.com/openbabel/openbabel/pull/1807/files
>

Thanks for pointing that out. Matt has also done a similar PR against the
RDKit (https://github.com/rdkit/rdkit/pull/1805), and that helps, but we've
gotten some feedback that this isn't the best solution to the problem.
There's another active PR where we're close to having an alternate fix
(amusingly, the same number as the OB fix:
https://github.com/rdkit/rdkit/pull/1807).

I think we're very close.
-greg



> 
> Pozdrawiam,  |  Best regards,
> Maciek Wójcikowski
> mac...@wojcikowski.pl
>
> 2018-04-04 5:39 GMT+02:00 Greg Landrum :
>
>> Dear all,
>>
>> As you may have noticed, the new release (2018.03) is late.
>>
>> This is not, as you might expect, connected to my previous email about
>> the backend code changes. It turned out to be much more difficult than
>> anticipated to straighten out the problems we were having with newer
>> versions of conda, particularly on the Mac, and we didn't want to do a
>> release until those were taken care of.
>>
>> It looks like we're almost there. Hopefully we will be able to do a beta
>> of the 2018.03 release by the end of the week.
>>
>> Best,
>> -greg
>>
>>
>> 
>> --
>> Check out the vibrant tech community on one of the world's most
>> engaging tech sites, Slashdot.org! http://sdm.link/slashdot
>> ___
>> Rdkit-devel mailing list
>> rdkit-de...@lists.sourceforge.net
>> https://lists.sourceforge.net/lists/listinfo/rdkit-devel
>>
>>
>
--
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