Orange3 add-on for Chemoinformatics.
Project description
Chemoinformatics
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Embedding molecules annotated with SMILES notation with CNN-based fingerprint,
allowing the use of Orange's standard arsenal of widgets for
clustering, classification or any other kind of
feature-based analysis. Use Molecule Viewer to visualize molecule 2D structures.
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Embedding molecules annotated with SMILES notation with CNN-based fingerprint,
allowing the use of Orange's standard arsenal of widgets for
clustering, classification or any other kind of
feature-based analysis. Use Molecule Viewer to visualize molecule 2D structures.
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