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github.com/aiidateam
- Villigen, Switzerland
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lab-cosmo/equisolve
lab-cosmo/equisolve Public archiveA ML toolkit package utilizing the metatensor data format to build models for the prediction of equivariant properties and gradients.
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scikit-learn-contrib/scikit-matter
scikit-learn-contrib/scikit-matter PublicA collection of scikit-learn compatible utilities that implement methods born out of the materials science and chemistry communities
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lab-cosmo/librascal
lab-cosmo/librascal PublicA scalable and versatile library to generate representations for atomic-scale learning
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osscar-org/scicode-widgets
osscar-org/scicode-widgets PublicA collection of widgets to prepare interactive scientific visualisations, including user code input and validation
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