mat_discover

A materials discovery algorithm geared towards exploring high-performance candidates in new chemical spaces.

MIT License

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552
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37
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6
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Ecosystems: PyTorch, Python

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mat_discover - 2.0.1

Published by sgbaird almost 3 years ago

What's Changed

fix bugs related to fit and count_repeats kwargs within suggest_first_experiment and suggest_next_experiment for adaptive design (Adapt class)

Full Changelog: https://github.com/sparks-baird/mat_discover/compare/2.0.0...2.0.1

mat_discover - 1.4.1

Published by sgbaird almost 3 years ago

Full Changelog: https://github.com/sparks-baird/mat_discover/compare/1.4.0...1.4.1

mat_discover - 1.2.3

Published by sgbaird almost 3 years ago

Full Changelog: https://github.com/sparks-baird/mat_discover/compare/1.2.2...1.2.3

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Top 16.15% on Pypi.org
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