xnn.ffnn.models#
Modules
DREIDING: the rule-generated generic force field. |
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DREIDING parameter library and generation rules. |
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ReaxFF parameter libraries: the SEAMM |
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Shared bonded-term geometry for fixed-topology force fields. |
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OPLS: the all-atom (and united-atom) fixed-topology force field. |
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OPLS parameter libraries: the SEAMM |
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ReaxFF: the reactive force field, classical and machine-learned (ReaxFF-nn). |
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Fixed molecular topology for valence force fields (OPLS and friends). |