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Machine learning for chemistry

Methods and Software

Choosing the right molecular machine learning potential

This article offers a lifeline for those lost in the sea of molecular machine learning potentials.

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By Mario Barbatti, 4 years ago
Methods and Software

MLatom – Atomistic machine learning

MLatom 2 is released.

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By Mario Barbatti, 4 years ago
Review

Machine learning for excited states

Review on machine learning for excited states.

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By Mario Barbatti, 4 years ago

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