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Mol2vec - an unsupervised machine learning approach to learn vector representations of molecular substructures
Python 266 118
Mol2vec notebooks for use with Binder service
Jupyter Notebook 29 18
Django based chemical database/inventory
JavaScript 18 7
Different useful and less useful cheminformatics related notebooks
Jupyter Notebook 7 5
Django and RDKit based interactive web-based SDF viewer
HTML 4 1
Forked from vinta/awesome-python
A curated list of awesome Python frameworks, libraries and software.
Python 2 2
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