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**Is your feature request related to a problem? Please describe.**
The current version of smarts contains a lot of different components but these components can conflict and cause problems with other…
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**Describe the bug**
Using `MolToMPL` with a SMARTS string throws the following error:
```
AttributeError: Line2D.set() got an unexpected keyword argument 'dash'
```
**To Reproduce**
```py…
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Back in 2018 I sent @cwhanse a Matlab wrapper for SMARTS we used on our UofA laboratory, with permission to publish, but got sidetracked and never documented. I just ported the code to Python and it s…
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@mwinokan has pointed out examples of synthesis route errors in [this issue](https://github.com/mwinokan/HIPPO/issues/94#issue-2272434775).
Things to check/Fix/Implement:
- [x] All deprotection…
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Given an input SMILES string and SMARTS query from the MACCS fingerprinting scheme (we are trying to implement this fingerprinting for the package) we found the following issue:
```julia
using Mol…
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I am trying to run PyBox (https://github.com/loftytopping/PyBox) and when I try to run umansysprop I keep getting the error _AttributeError: module 'pybel' has no attribute 'Smarts'_. This is trigger…
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## Is your feature request related to a problem? ##
OpenForceField has a really nice function called `chemical_environment_matches` that returns only the tagged atoms in a SMARTS substructure sea…
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**Submitting author:** @trevorgokey (Trevor Gokey)
**Repository:** https://github.com/trevorgokey/besmarts
**Branch with paper.md** (empty if default branch): joss-manuscript
**Version:** 0.1.0
**Edit…
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SMARTS are already in many chemistry frameworks, such as CDK, babel, chemaxon etc.
Instead of SIMILES use SMARTS.
Example:
https://github.com/openbabel/openbabel/blob/master/data/SMARTS_InteLigan…