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Interaction-Force Transport Gradient Flows

NeurIPS 2024 · Optimization › Nonconvex and smooth optimization · approach: Acceleration and Nesterov dynamics · 0 citations (OpenAlex)

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Proposes interaction-force transport (IFT) gradient flows over non-negative and probability measures, combining Wasserstein and kernel MMD geometries via inf-convolution, with a JKO-splitting particle algorithm and global exponential convergence guarantees for MMD and KL energies.

Problem

Gradient flows for minimizing MMD or KL energies over measures lack global convergence guarantees; MMD-based particle flows collapse to modes or get stuck at local minima and need heuristic noise injection, and kernel-mean-embedding methods cannot transport mass.

Approach

Construct a new gradient flow dissipation geometry by inf-convolving the Wasserstein tensor with a kernelized (MMD) Hellinger-type tensor, yielding a reaction-diffusion-like flow that both transports and teleports mass; a mass-preserving spherical variant is derived for probability measures.

Key results

Measured effects reported in the paper

What was changedWhereMeasuredEffect
Use spherical IFT instead of vanilla MMD flowMMD sampling · Gaussian target in 2Dsample qualityHelped
Use spherical IFT instead of noise-injected MMD flowMMD sampling · Gaussian target in 2DaccuracyNo clear effect
Use spherical IFT instead of noise-injected MMD flowMMD sampling · Gaussian target in 2Diterations to approach targetHelped
Use spherical IFT instead of noise-injected MMD flowMMD sampling · Gaussian target in 2Dneed for heuristic noise injectionHelped
Use IFT gradient flow for squared MMD energyIFT gradient flow · Non-negative measuressquared MMD energy decayHelped
Use spherical IFT gradient flow for KL energySpherical IFT gradient flow · Probability measures with a -log-concave targetKL divergence decayHelped

Surprising findings

Limitations

Experimental setup

Datasets: synthetic Gaussian target samples synthetic Gaussian mixture target samples

Benchmarks: 2D Gaussian target 2D Gaussian mixture target 100D Gaussian mixture target

Metrics: squared MMD loss

Baselines: MMD flow (Arbel et al.) MMD flow with noise injection Wasserstein-Fisher-Rao flow of MMD

Builds on: Wasserstein gradient flow Hellinger-Kantorovich (Wasserstein-Fisher-Rao) gradient flow MMD flow JKO scheme Bakry-Emery theorem

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