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HORSE: Hierarchical Representation for Large-Scale Neural Subset Selection

NeurIPS 2024 · Architectures and efficiency › RNNs and normalization · approach: Symmetry and equivariance in loss landscapes · 0 citations (OpenAlex)

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Proposes HORSE, an attention-based hierarchical set encoder for neural subset selection that satisfies a defined Identity Property and permutation invariance, enabling chunked processing of large ground sets.

Problem

Neural subset selection needs set functions that capture interactions between the selected subset and the full ground set, while scaling to supersets too large to fit in memory.

Approach

Partition the ground set into chunks with learned slot embeddings, use a normalized subset-based attention to encode each chunk, and aggregate chunk encodings so the representation identifies the ground set regardless of partitioning (Identity Property), then concatenate with the subset encoding and feed an MLP.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
Use HORSE instead of the strongest baselineNeural subset selection · Synthetic datasets: Two Moons and Gaussian MixtureMJC: 58.5 ± 0.3 -> 60.2 ± 0.5; 90.9 ± 0.2 -> 91.8 ± 0.2Helped
Use HORSE instead of the strongest baselineProduct recommendation · Amazon baby registry categoriesMJC: 80.8±1.2 -> 83.2±1.3; 88.3±0.7 -> 88.0±0.8Mixed
Use HORSE instead of the strongest baselineCompound selection · PDBBind, BindingDB, PDBBind-2, BindingDB-2MJC: 93.5±0.8 -> 94.1 ± 0.7; 19.8±0.5 -> 21.3 ± 0.5Helped
Increase the Monte-Carlo sample number k from 2 to 8 (ablation)HORSE product recommendation · MediaMJC: 63.1 ± 1.2 -> 66.8 ± 1.3Helped
Increase the Monte-Carlo sample number k from 2 to 10 (ablation)HORSE product recommendation · SafetyMJC: 24.8 ± 1.3 -> 27.7 ± 0.8Helped
Increase the Monte-Carlo sample number k from 8 to 10 (ablation)HORSE product recommendation · MediaMJC: 66.8 ± 1.3 -> 66.2 ± 0.9Hurt

Surprising findings

Limitations

Experimental setup

Datasets: Two-Moons Gaussian Mixture Amazon baby registry Double MNIST CelebA F-MNIST CIFAR-10 PDBBind BindingDB

Benchmarks: Two-Moons Gaussian Mixture Amazon baby registry product recommendation Double MNIST CelebA F-MNIST CIFAR-10 PDBBind BindingDB

Metrics: mean Jaccard coefficient (MJC)

Baselines: Random PGM DeepSet Set Transformer EquiVSet INSET

Builds on: EquiVSet INSET Set Transformer DeepSets Set Slot Attention

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