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### Model Name
DrugTax
### Model Description
DrugTax is a python package for drug taxonomy identification and explainable feature extraction
### Slug
drugtax
### Tags
taxonomy cla…
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Hello,
I am using Chem Composer for my web service. When I draw a simple organic reaction, like A -> B and click "Convert" button everything works fine. The reaction is sent to the backend as Kek…
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### Model Name
RLM Stability
### Model Description
Prediction of hepatic metabolic stability is a key pharmacokinetic parameter in drug discovery. Hepatic metabolic stability can prevent a dr…
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Hello, I would like to suggest a new feature or more an upgrade inside the experiment module.
We use to have a molecule drawer. instead of it, i would be more interesting to have the possibility …
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Loading an aromatic molecule from SMILES using `smilestomol` gives a `GraphMol` object, `mol`.
`isaromaticbond(mol)` returns the correct BitVector for which bonds are aromatic; `[x.isaromatic for x i…
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A picky point from an old organic chemist. No one I know wants to look at aromatic rings with circles in the center. IMO, structure display should default to Kekule. At the very least, an option s…
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Hello,
I need to parse a chemical formula generated by the formula tool for a reaction drawn in Composer (.kcj format) but ran into a problem of not finding parenthesis in .kcj file. For example, w…
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I would like to make a button to add atomSymbol by referring to the demo code. #209
Even if the code is operated as it is, the controller class that I created will not be called properly.
I think i…
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Given the Kekule SMILES:
```
C1=NC2=C(N1)CCC3=NON=C23 11048
```
...OpenChemLib (2018.5) writes out the following aromatic SMILES:
```
C(Cc1nonc-11)c2c1nc[nH]2
```
I think that you probably…
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API_AUTH is undefined when the gid checker function attempts to authenticate to kekule games to validate the game ID