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Mixture of Link Predictors on Graphs

NeurIPS 2024 · Graph learning › GNN architectures · approach: Graph structure learning · 6 citations (OpenAlex)

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Proposes Link-MoE, a mixture-of-experts model that routes each node pair to existing link predictors (GNN4LP models and heuristics-based experts) using a gating network over pairwise heuristic and feature inputs, trained in a two-step procedure.

Problem

Link prediction methods typically apply one pairwise strategy uniformly to all node pairs, while different pairs in the same dataset need different heuristics and different GNN4LP models perform best in different regimes.

Approach

Treat existing link predictors as experts and learn a gating network, conditioned on node-pair features and structural heuristics (CN, AA, RA, shortest path, Katz, PPR, degree), that assigns per-pair weights to experts; experts are trained first, then only the gating model is trained on a split of the validation set.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
use pair-specific gating to combine experts instead of LPFormerLink-MoE · CoraMRR: 10.80%Helped
use pair-specific gating to combine experts instead of LPFormerLink-MoE · CiteseerMRR: 3.16%Helped
use pair-specific gating to combine experts instead of NBFNetLink-MoE · PubmedMRR: 18.71%Helped
use pair-specific gating to combine experts instead of LPFormerLink-MoE · ogbl-collabHits@50: 4.67%Helped
use pair-specific gating to combine experts instead of LPFormerLink-MoE · ogbl-ppaHits@100: 9.59%Helped
use pair-specific gating to combine experts instead of Global-EnsembleLink-MoE · ogbl-citation2MRR: 0.58%Helped
activate only the Top-3 experts instead of all experts (ablation)Link-MoE · ogbl-collabHits@50: 66.13 -> 71.94Helped
use 3 experts instead of all experts (ablation)Link-MoE · ogbl-collabHits@50: 71.32 -> 71.25No clear effect
use 4 experts instead of all experts (ablation)Link-MoE · ogbl-collabHits@50: 71.32 -> 72.75Helped
activate only the Top-3 experts instead of all experts (ablation)Link-MoE · PubmedMRR: 53.10 -> 51.13Hurt
use 3 experts instead of all experts (ablation)Link-MoE · PubmedMRR: 53.10 -> 52.03Hurt
use 4 experts instead of all experts (ablation)Link-MoE · PubmedMRR: 53.10 -> 52.30Hurt

Surprising findings

Limitations

Experimental setup

Datasets: Cora Citeseer Pubmed ogbl-collab ogbl-ppa ogbl-citation2 Chameleon Squirrel

Benchmarks: Cora Citeseer Pubmed ogbl-collab ogbl-ppa ogbl-citation2 Chameleon Squirrel

Metrics: MRR Hits@K

Baselines: CN AA RA Shortest Path Katz Node2Vec MF MLP GCN GAT SAGE GAE

Builds on: Mixture of Experts NCN NCNC Neo-GNN BUDDY LPFormer

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