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Derivative-Free Diffusion Manifold-Constrained Gradient for Unified XAI
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Proposes FreeMCG, a derivative-free, black-box gradient approximation that uses diffusion-model Tweedie particles and ensemble Kalman filter covariance to give on-manifold gradients for both feature attribution and counterfactual explanation.
Problem
Gradient-based XAI needs white-box model access, is vulnerable to adversarial-like off-manifold attributions, and feature attribution and counterfactual explanation are treated as separate tasks.
Approach
Approximate the classifier's gradient projected onto the data manifold without derivatives: sample particles via diffusion Tweedie denoising, and estimate the covariance-preconditioned gradient as the cross-covariance between particles and classifier logits (EnKF-style), then use it for both attribution and reverse-diffusion counterfactual generation.
Key results
- Counterfactuals: FreeMCG achieves perceived change 1.65 versus 2.35 for DVCE* and 2.00 for LDCE on the human study, with lower flip rate (51.5%) than DVCE* (85.8%) and LDCE (61.7%).
- FreeMCG has the steepest prediction decline among gradient-based attribution methods on ROAD, approaching the SHAP lower bound.
- FreeMCG achieves L2 1001.02 and FID 1001.02-scale values comparable to DVCE* (995.92), while LDCE has FID 1351.39.
Measured effects reported in the paper
| What was changed | Where | Measured | Effect |
|---|---|---|---|
| Use FreeMCG instead of gradient-based counterfactual methods | Counterfactual generation with ResNet-50 · ImageNet validation | flip rate: 85.8 vs 51.5 | Hurt |
| Use FreeMCG instead of gradient-based counterfactual methods | Counterfactual generation with ResNet-50 · perceived change | perceived change: 2.35 vs 1.65; 2.00 vs 1.65 | Helped |
| Use FreeMCG instead of gradient-based counterfactual methods | Counterfactual generation with ResNet-50 · ImageNet validation | FID: 71.38 vs 66.89; 63.04 vs 66.89 | Mixed |
| Use FreeMCG for feature attribution rather than gradient-based attribution methods | Feature attribution · ImageNet and MIMIC-CXR | ROAD prediction decline | Helped |
Surprising findings
- Gradient-based counterfactual baselines often fool the classifier without semantically meaningful change, behaving like adversarial attacks.
- FreeMCG has a lower flip rate than gradient-based baselines, since it lacks model gradients, yet is judged to produce more perceived change.
Limitations
- Requires black-box access to logits; not applicable when only class predictions are available.
- Reverse-diffusion counterfactual variant is slower and the simple gradient ascent variant is hyperparameter-sensitive.
- Flip rate is lower than gradient-based baselines, since the method does not use model gradients.
Experimental setup
Datasets: ImageNet MIMIC-CXR
Benchmarks: ImageNet validation set (counterfactuals, 1K) MIMIC-CXR (ROAD feature attribution) ImageNet (ROAD feature attribution)
Metrics: flip rate L2 distance FID perceived change perceived similarity perceived realism ROAD prediction drop
Baselines: DVCE LDCE Vanilla gradient Integrated Gradients InputXGradient SHAP
Builds on: Tweedie's formula ensemble Kalman filter DVCE LDCE SDEdit
Closest papers by meaning
- Understanding and Improving Training-free Loss-based Diffusion Guidance (NeurIPS 2024 · similarity 0.87)
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- LGDM: Latent Guidance in Diffusion Models for Perceptual Evaluations (ICML 2025 · similarity 0.85)
- Diffusion Model's Generalization Can Be Characterized by Inductive Biases toward a Data-Dependent Ridge Manifold (NeurIPS 2026 · similarity 0.85)
- Structure-Guided Adversarial Training of Diffusion Models (CVPR 2024 · similarity 0.85)
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