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proppe-group
QSRR-Benzhydrylium
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50eacdc8829ba50a1e9b618d565a86c702e08c43
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Jonny Proppe
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1 year ago
50eacdc8
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50eacdc8
1 year ago
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QC_and_descriptor_dataframe.pkl
QC_and_descriptor_dataframe_ref.pkl
QC_values_and_MLR_predictions.pkl
QSRR_MLR_model_coefficients.pkl
QSRR_MLR_notebook.ipynb
QSRR_structural_descriptor_generation_from_xyz.ipynb
README.md
names.txt
structure_generator.zip
README.md
QSRR-Benzhydrylium
