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AmirMasoud
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GMD

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molecular-dynamics

machine-learning-force-fields

compositional-generalisation

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GMD / data

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AmirMasoud's picture

[UPLOAD] Dataset with PBE level of theory has been added

438149d verified 4 months ago

Alcohols
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
Aldehydes
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
Alkanes
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
Amides
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
Amines
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
AminoAcids
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
CarboxylicAcids
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
CycloComplexes
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
DiAmines
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
DiCarboxylicAcids
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
KetoAldehydes
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
Polyols
[UPLOAD] Dataset with PBE level of theory has been added 4 months ago