hotwa 0d99f7d12c first add

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analyze_ring12_20_molecules_CLEAN.ipynb

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analyze_ring16_molecules.ipynb

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demo_single_molecule.ipynb

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drug_screening_sandmeyer.ipynb

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filter_molecules.ipynb

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mactch_test.ipynb

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rdkit_show.ipynb

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README_analyze_ring16.md

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screen_aniline_candidates_executed.ipynb

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screen_aniline_candidates.ipynb

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screen_sandmeyer_candidates.ipynb

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SIME-MacroValidator.ipynb

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smarts_match_visualization.ipynb

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test_align_two_molecules.ipynb

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