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basf
mlipx basf
5
62
mit
7
Machine-Learned Interatomic Potential eXploration (mlipx) is designed at BASF for evaluating machine-learned interatomic potentials (MLIPs). It offers a growing set of evaluation methods alongside pow...
mlips machine-learning testing-framework materials-informatics interatomic-potentials
Created 2024-10-18
56 commits to main branch, last one 25 days ago
autoatml
autoplex autoatml
9
54
gpl-3.0
4
Code for automated fitting of machine learned interatomic potentials.
mlips ml-potentials atomistic-modelling atomistic-simulations high-throughput-computing atomistic-machine-learning machine-learned-interatomic-potentials
Created 2023-07-26
1,705 commits to main branch, last one 2 days ago