GitHub - risg99/Computational-Drug-Discovery-Bioinformatics-Project: This repository depicts how to gather the biological data for computation, studying it, pre-processing it, modeling it, applying ML algorithms and making predictions.

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This repository depicts how to gather the biological data for computation, studying it, pre-processing it, modeling it, applying ML algorithms and making predictions.

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Name		Name	Last commit message	Last commit date
Latest commit History 1 Commit
BioinformaticsProject-Computational-Drug-Discovery.ipynb - Colaboratory.pdf		BioinformaticsProject-Computational-Drug-Discovery.ipynb - Colaboratory.pdf
BioinformaticsProject_Computational_Drug_Discovery.ipynb		BioinformaticsProject_Computational_Drug_Discovery.ipynb
bioactivity_2class_df.csv		bioactivity_2class_df.csv
bioactivity_class_pic50.csv		bioactivity_class_pic50.csv
bioactivity_combined_dataframe.csv		bioactivity_combined_dataframe.csv
bioactivity_data_class_pIC50_pubchem_fp.csv		bioactivity_data_class_pIC50_pubchem_fp.csv
bioactivity_data_preprocessed.csv		bioactivity_data_preprocessed.csv
descriptors_output.csv		descriptors_output.csv
mannwhitneyu_LogP.csv		mannwhitneyu_LogP.csv
mannwhitneyu_MW.csv		mannwhitneyu_MW.csv
mannwhitneyu_NumHAcceptors.csv		mannwhitneyu_NumHAcceptors.csv
mannwhitneyu_NumHDonors.csv		mannwhitneyu_NumHDonors.csv
mannwhitneyu_pIC50.csv		mannwhitneyu_pIC50.csv
plot_LogP.png		plot_LogP.png
plot_MW.png		plot_MW.png
plot_MW_vs_LogP.png		plot_MW_vs_LogP.png
plot_NumHAcceptors.png		plot_NumHAcceptors.png
plot_NumHDonors.png		plot_NumHDonors.png
plot_bioactivity_class.png		plot_bioactivity_class.png
plot_ic50.png		plot_ic50.png

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This repository depicts how to gather the biological data for computation, studying it, pre-processing it, modeling it, applying ML algorithms and making predictions.

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