Re: [Rdkit-devel] InChI 1.05

[Igor F. <igo...@gm...>]

Great!

On Fri, Feb 24, 2017 at 8:55 AM, Greg Landrum <gre...@gm...>
wrote:

> Yeah, I was testing using master and everything is fine.
>
> On Fri, Feb 24, 2017 at 2:51 PM, Igor Filippov <igo...@gm...>
> wrote:
>
>> Greg,
>>
>> Thank you for the kind words!
>> I should note that I am using a slightly older version of rdkit (half a
>> year to a year old), but I don't think it makes a difference as far as
>> InChI is concerned.
>>
>> Best regards,
>> Igor
>>
>>
>> On Fri, Feb 24, 2017 at 8:43 AM, Greg Landrum <gre...@gm...>
>> wrote:
>>
>>> Thanks Igor! I was not looking forward to getting this working, so it's
>>> great that someone else managed to.
>>>
>>> I need to do a bit more tweaking in order to get the download to work
>>> using the cmake code instead of the download_inchi.sh script, but I should
>>> be done with that pretty quickly.
>>>
>>> I'll have a branch up for review soon (assuming that nothing goes wrong)
>>>
>>> -greg
>>>
>>>
>>> On Thu, Feb 23, 2017 at 4:55 AM, Igor Filippov <
>>> igo...@gm...> wrote:
>>>
>>>> As InChI 1.05 is officially out I've tinkered with RDKit build system a
>>>> bit
>>>> to include the new version. Two updated files - CMakeLists.txt   and
>>>> download-inchi.sh
>>>> from External/INCHI-API/ are attached in case it may be useful to
>>>> others.
>>>>
>>>> Best regards,
>>>> Igor
>>>>
>>>>
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>>>
>>
>