django-rdkit

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Looks like there is a new-ish parameter for [enhanced stereo during substructure searching](https://www.rdkit.org/docs/Cartridge.html#parameters): `do_enhanced_stereo_sss`. Currently, if I try setting that, I get an exception: ``` self = name = 'do_enhanced_stereo_sss',...

coleshaw

Hi, would you be interested in packaging this for release on the Python Package Index? I would be willing to lend a hand in making this easy through use of...

radusuciu

Hello! How to use qmol field. And what is difference between mol field and qmol? Looking at the code one gets the impression that there is no difference

ivannnnnnnnnn

I recently needed to do substructure queries that take into account explicit hydrogens. I found out that the `mol_adjust_query_properties()` cartridge function does what I want. I gathered that there is...

adam-of-barot

Hello! Sorry for the possibly off topic question and my English) But maybe django-rdkit community help me with my trouble I am using django-rdkit for store mol objects. In my...

ivannnnnnnnnn

Any plans to publish this on PyPI?

harryjubb

NameError: name 'forms' is not defined

1

Hello, thank you for this project that helped me a lot, I'm using Django 1.11, I recently tried to use a molecule MolField in a django model and I got...

taryep

I recently tried to add a fingerprint field to a model and then perform a migration. Following the [documentation](http://django-rdkit.readthedocs.org/en/latest/fields.html), which suggests > `class django_rdkit.models.BfpField(**options)` > A bit vector fingerprint. It...

jan-grimo

Hi, I just noticed that the [tutorial on RTD](https://django-rdkit.readthedocs.io/en/latest/tutorial.html) misses the changes from #16.

dalito