MCP LAMMPS Server

# Core MCP dependencies mcp>=1.0.0 # LAMMPS Python interface lammps>=2023.0.0 # Data processing and scientific computing numpy>=1.21.0 scipy>=1.7.0 pandas>=1.3.0 # Visualization matplotlib>=3.5.0 # Data validation and serialization pydantic>=2.0.0 # File handling and configuration pyyaml>=6.0 pathlib2>=2.3.0 # Async support asyncio-mqtt>=0.11.0 # Development dependencies pytest>=7.0.0 pytest-asyncio>=0.21.0 black>=22.0.0 flake8>=5.0.0 mypy>=1.0.0 # Optional: GPU support # cupy>=11.0.0 # Uncomment if CUDA support is needed