drug-discovery

10 projects share this GitHub topic

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🧬 Members

scientific-agent-skills

Turn any AI agent into an AI Scientist. The #1 Agent Skills library for science, used by 170,000+ scientists…

DeepLearningExamples

State-of-the-Art Deep Learning scripts organized by models - easy to train and deploy with reproducible…

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

Message Passing Neural Networks for Molecule Property Prediction

A powerful and flexible machine learning platform for drug discovery

An AI co-scientist powered by Scientific Agent Skills running on your desktop.

AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and…

Deep Reinforcement Learning for de-novo Drug Design

The world's most powerful open-source bio AI assistant - Access academic literature, clinical trials, drug…

🦀 Agentic RAG for drug intelligence · 57 skills · 15 task categories · DTI · ADR · DDI · PGx ·…

🔗 Related families

bioinformatics 17 materials-science 5 scientific-computing 18 chemistry 4 drug-design 6 ai-scientist 8 claude-skills 83 claudecode 16

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