by deepmodeling · Agent Tool · ★ 79
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AI4S-agent-tools An open project by the DeepModeling community - Building intelligent tools for scientific research. 🌐 View Tool Showcase | 🤝 Contribute | 🎯 Mission We're building a comprehensive "scientific capability library" - agent-ready tools that cover the full spectrum of AI for Science tasks: 🔬 Current Tools Materials Science DPACalculator - Deep learning atomistic simulations with universal potentials Thermoelectric - Materials screening with CALYPSO ABACUS-tools - First-principles calculations with ABACUS Chemistry PubChem - Compound data retrieval and structure download Catalysis - Reaction calculations with ADSEC workflow Research Tools Paper Search - ArXiv literature search and parsing DeepMD Docs RAG - Documentation knowledge base 🚀 Coming Soon 📊 Spectral analysis (XRD, NMR, Raman) 🧬 Protein structure prediction 🔭 3D molecular visualization 📈 Experimental design optimization 🧫 Multi-objective Bayesian optimization 💻 Quick Start Use a Tool Add Your Tool bash Copy template cp -r servers/e
| Stars | 79 |
| Forks | 28 |
| Language | Python |
| Category | Agent Tool |
| License | MIT |
| Quality Score | 66.2107353004211/100 |
| Open Issues | 1 |
| Last Updated | 2026-02-19 |
| Created | 2025-05-26 |
| Platforms | python |
| Est. Tokens | ~4727k |
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AI4S-agent-tools is Collecting a variety of Agent-Ready tool modules. It is categorized as a Agent Tool with 79 GitHub stars.
AI4S-agent-tools is primarily written in Python.
You can find installation instructions and usage details in the AI4S-agent-tools GitHub repository at github.com/deepmodeling/AI4S-agent-tools. The project has 79 stars and 28 forks, indicating an active community.
AI4S-agent-tools is released under the MIT license, making it free to use and modify according to the license terms.
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