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Atomistic machine learning models you can use everywhere for everything
Python 38 8
Self-describing sparse tensor data format for atomistic machine learning and beyond
Python 98 25
Computing representations for atomistic machine learning
Rust 79 18
Library for reading and writing chemistry files
C++ 195 56
Array of Struct to Struct of Array helpers in Rust
Rust 484 30
Compute neighbor lists for atomistic systems
Python 74 13