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synthesis-agent Public
Forked from hspark1212/synthesis-agent2025 LLM Hackathon for Applications in Materials and Chemistry
Python UpdatedJul 20, 2026 -
chemeleon2 Public
Forked from hspark1212/chemeleon2A RL framework for Crystal Structure Generation using GRPO
Python MIT License UpdatedNov 27, 2025 -
pymatviz Public
Forked from janosh/pymatvizA toolkit for visualizations in materials informatics.
Python MIT License UpdatedNov 10, 2025 -
compchem_toolkit Public
Forked from ireaml/compchem_toolkitCollection of python functions to work with aiida, pymatgen and VASP. Designed to speed up input setup and output analysis.
Python MIT License UpdatedJul 23, 2025 -
SMACT Public
Forked from WMD-group/SMACTPython package to aid materials design and informatics
Python MIT License UpdatedJul 11, 2025 -
maml Public
Forked from materialyzeai/mamlPython for Materials Machine Learning, Materials Descriptors, Machine Learning Force Fields, Deep Learning, etc.
Jupyter Notebook BSD 3-Clause "New" or "Revised" License UpdatedJul 7, 2025