Gordon Bell Prize Winners Leverage Machine Learning For Molecular Dynamics

Retrieved on: 2020-11-23 17:37:30

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Physical sciences

Natural sciences

Chemistry

Computational chemistry

Theoretical chemistry

Ab initio quantum chemistry methods

Force field

Supercomputer

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Gordon Bell Prize Winners Leverage Machine Learning For Molecular Dynamics. View article details on hiswai:

Excerpt

Molecular dynamics schemes based on <b>machine learning</b> models trained with ab initio data in recent years held the promise of boosting AIMD and the ...

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