Hi Greg,

Many thanks for the help, works now, I can now use this amazing software!

Cheers,
Jordan

On Wed, Oct 4, 2017 at 10:35 PM, Greg Landrum <greg.land...@gmail.com>
wrote:

> Hi Jordan,
>
> Sorry this is frustrating. This is, unfortunately, connected to the
> problem I posted about here:
> https://www.mail-archive.com/rdkit-discuss@lists.
> sourceforge.net/msg07315.html
>
> At the time I thought that only the Mac (and possibly linux) was affected,
> but thanks to your warning I've just verified that this also is a problem
> on Windows.
>
> The solution for you is to "downgrade" to conda version 4.3.25.
> You can do this by :
> - making sure the default conda environment is active by typing
> "deactivate" at the command prompt
> - conda install conda=4.3.25                   <- grabs the older version
> of conda
> - conda env remove -n my-rdkit-env       <- this is the environment you
> created, it's easiest to just start over
> - conda create -n my-rdkit-env python=2.7 rdkit           <- should now
> work to create an environment in one step
>
> When you execute that last command, it will show the list of packages it's
> going to install and prompt for whether or not you want to proceed. Please
> check that the python version listed is 2.7.13-1.
>
> Many apologies for the problems. This was a mistake by the anaconda team
> and it's made a mess.
>
> Best,
> -greg
>
>
>
>
> On Wed, Oct 4, 2017 at 10:35 AM, Jordan McCone <urlolj0...@gmail.com>
> wrote:
>
>> Hi,
>>
>> Another case of 'my rdkit doesn't work'.
>>
>> I have been trying to get it working for a very long time now (on and off
>> for the last few days). I would really like to use the ETKDG function of
>> this software to generate the 3D conformers of ligands for a virtual
>> screening library.
>>
>> I have tried to install RDKit using via conda, closely following the
>> instructions from http://www.rdkit.org/docs/Install.html
>>
>> After activating my environment I type
>>
>> 'python', and then
>>
>> 'import rdkit'.
>>
>> However, I get the following error:
>>
>> [image: Inline image 1]
>>
>> I am using Windows 10.
>>
>> Any help would be really appreciated, I have never had to install a
>> program this way before, so have no clue what I am doing.
>>
>>
>>
>>
>>
>>
>>
>>
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>
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