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materialsvirtuallab
maml materialsvirtuallab
79
376
bsd-3-clause
20
Python for Materials Machine Learning, Materials Descriptors, Machine Learning Force Fields, Deep Learning, etc.
spectroscopy deep-learning machine-learning materials-science materials-discovery machine-learning-force-field
Created 2020-01-25
1,772 commits to master branch, last one about a month ago
microsoft
mattersim microsoft
14
243
mit
6
MatterSim: A deep learning atomistic model across elements, temperatures and pressures.
mlff ai4science ai4materials machine-learning foundation-models materials-science machine-learning-force-field computational-materials-science
Created 2024-09-06
95 commits to main branch, last one 3 days ago