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AiiDA-TrainsPot
User’s guide
Get Started with aiida-trains-pot
API reference
Workchains
Main TrainsPot WorkChain
Dataset Augmentation WorkChain
Ab Initio Labelling WorkChain
Training WorkChain
Exploration WorkChain
MACE Training WorkChain
Calculations
MACE Training Calculation
Evaluation Calculation
Parsers
Data Types
Scripts
Repository
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