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Dependencies
- ase
- inquirerpy
- matplotlib
- mlfsm
- networkx
- numpy
- prettytable
- prism-pruner
- psutil
- racerts >=0.1.6
- rdkit >=2025.9.3
- rich
- scipy
- sella >=2.4.2
4 optional dependencies
- aimnet[full]
- aimnet[aimnet2]
- fairchem-core[uma]
- fairchem-core[full]