m2d2-labs/awesome-ml-for-biochemistry

Community-curated resources for research at the intersection of AI and molecular sciences

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This resource helps biochemists, medicinal chemists, and drug discovery scientists navigate the rapidly evolving field of machine learning for molecular sciences. It offers curated lists of learning materials, high-impact research, useful software libraries, and high-quality datasets. The goal is to provide a structured entry point and ongoing reference for integrating AI into biochemical research.

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Use this if you are a researcher or practitioner in biochemistry or drug discovery looking to understand, learn, or apply machine learning techniques in your work.

Not ideal if you are looking for a standalone software tool to directly run experiments or analyze data without exploring external resources.

drug-discovery medicinal-chemistry biochemical-research cheminformatics molecular-science
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Last pushed

Aug 12, 2024

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