Jupyter Notebook to show basic molecular rendering in Python #2698
bertiewooster
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I went ahead and published the post on my blog as Drawing molecules with EPAM’s Indigo cheminformatics library. I welcome any feedback. |
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I started playing with Indigo and was unable to find examples of drawing molecules in a Python Jupter Notebook, so I drafted one. Here's an excerpt, both as code and a screenshot:
Would this notebook be welcomed as a contribution to this repo? If so, where should I put it? The only Jupyter Notebooks I found are in Indigo/utils/indigo-ml/notebooks.
If not, I'm happy to publish the notebook on my cheminformatics blog.
Either way, I welcome any feedback on the notebook, for example any code improvements.
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