A chemical analysis of lipophilicities & molecule drawings including ML

Last update: Nov 22, 2022

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Overview

A chemical analysis of lipophilicity & molecule drawings including a bit of ML analysis.

This is a simple project that includes two Jupyter files (one about lipophilicity & the other about drawing structures) with a few data files like this. An analysis of lipophilicity & molecule drawings are shown through simple chemistry projects that looks at lipophilicity of drug molecules through ML and molecule drawings through RDKit.

Project of a chemical analysis implementing machine learning is almost finished.

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The folder includes logo while additional files removed through to save space.

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Owner

Aurimas A. Nausėdas

Developer, Data Engineer, and a graduate of The University of Edinburgh. Passionate about creating things.

GitHub Repository

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