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Unbalancedness in Neural Monge Maps Improves Unpaired Domain Translation

ICLR 2024 · Label-efficient and robust learning › Recognition and long-tail · approach: Dense features and foundation priors · 4 citations (OpenAlex)

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Proposes a re-scaling scheme that makes any neural Monge map estimator unbalanced via a discrete unbalanced OT coupling, and applies it to OT-ICNN, Monge gap, and OT flow matching (UOT-FM) across single-cell, perturbation, and image translation tasks.

Problem

Classic optimal transport enforces mass conservation, making neural Monge map estimators sensitive to outliers and class imbalance between source and target distributions, which hurts unpaired domain translation.

Approach

Prove that an unbalanced Monge map between two measures equals a balanced Monge map between rescaled measures obtained from the unbalanced OT coupling; this rescaling (estimated batch-wise with entropic UOT) can be plugged into any balanced Monge map estimator, including OT flow matching.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
Use unbalanced OT couplings instead of balanced couplingsOT-FM · EMNIST digits → letters (average)FID: 36.9 -> 23.0Helped
Use unbalanced OT couplings instead of balanced couplingsOT-FM · EMNIST digits → letters (8 → B)FID: 83.1 -> 42.6Helped
Use unbalanced OT couplings instead of balanced couplingsOT-FM · CelebA 256x256 Male → FemaleFID: 14.6 -> 13.9Helped
Use unbalanced OT couplings instead of balanced couplingsOT-FM · CelebA 256x256 Female → MaleFID: 14.8 -> 14.3Helped
Use unbalanced OT couplings instead of balanced couplingsOT-FM · CelebA 256x256 Remove GlassesFID: 20.9 -> 18.5Helped
Use unbalanced OT couplings instead of balanced couplingsOT-FM · CelebA 256x256 Add GlassesFID: 20.1 -> 18.3Helped
Use unbalanced OT reweightingOT-ICNN · Single-cell pancreas trajectory inference (Ngn3 EP)correct transitions: 7% -> 69%Helped
Use unbalanced OT reweightingOT-ICNN · Single-cell pancreas trajectory inference (EB)correct transitions: 54% -> 57%Helped
Use unbalanced OT reweightingOT-ICNN · Single-cell pancreas trajectory inference (NEB)correct transitions: 67% -> 85%Helped
Use unbalanced OT instead of balanced OTOT-FM · CIFAR-10FID: 3.59 -> 3.47; 3.42; 3.79Mixed
Set τ=0.97 (ablation)UOT-FM · CIFAR-10FID: 3.59 -> 3.42Helped
Lower τ from 0.99 to 0.95 (ablation)UOT-FM · CIFAR-10FID: 3.47 -> 3.79Hurt

Surprising findings

Limitations

Experimental setup

Datasets: EMNIST CelebA CIFAR-10 mouse pancreas scRNA-seq 4i drug perturbation data sciPlex

Benchmarks: EMNIST digits-to-letters CelebA 256x256 CelebA 64x64 CIFAR-10 single-cell trajectory inference (CellRank-based cell transitions) 4i drug response sciPlex

Metrics: FID attribute-wise FID transport cost Sinkhorn divergence L2 drug signature percentage of correct cell transitions

Baselines: OT-ICNN OT-MG OT-FM FM CycleGAN UVCGAN NOT scVelo TrajectoryNet WOT

Builds on: OT-ICNN Monge gap OT flow matching Sinkhorn algorithm unbalanced optimal transport

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