sGDML: constructing accurate and data efficient molecular force fields using machine learning (Q2696420)
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| Language | Label | Description | Also known as |
|---|---|---|---|
| English | sGDML: constructing accurate and data efficient molecular force fields using machine learning |
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sGDML: constructing accurate and data efficient molecular force fields using machine learning (English)
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14 April 2023
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machine learning potential
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machine learning force field
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ab initio molecular dynamics
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path integral molecular dynamics
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coupled cluster calculations
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molecular property prediction
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quantum chemistry
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gradient domain machine learning
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