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ResearchFormerly WizWand

Conditional 3D Molecular Graph Generation on QM9 In-Distribution (ID)

41Polarizability (alpha) (Bohr^3)Random
13.876820.918427.9635.0016Oct 12, 2025
Updated 7mo ago

Evaluation results

MethodLinks
RandomMethod Category=Random Sampler2025.1041193.36103.3121.838.413.566.3
EDMMethod Category=Diffusion2025.1020.15287158.7166.27.0113.637.6
SVDDMethod Category=Inference-Time, Backbone=LDM-3DG2025.1016.78115.1160.0767.396.2613.575.2
Best-of-NMethod Category=Inference-Time, Backbone=LDM-3DG2025.1016.23109.9758.1167.086.2713.544.2
Beam SearchMethod Category=Inference-Time, Backbone=LDM-3DG2025.1016.04108.0657.1466.056.2913.583.7
LDM–3DGMethod Category=Diffusion2025.1015.56107.1454.6263.086.3313.664.9
TAGMolMethod Category=Inference-Time, Backbone=LDM-3DG2025.1015.33100.1955.0963.066.1313.472.7
TreeDiffMethod Category=Inference-Time, Backbone=LDM-3DG2025.1014.9295.2161.5560.196.0713.411.4