Composing and Steering Diffusion Models with Generalized Feynman-Kac Correctors

Inference-time scaling adapts pretrained diffusion models to new sampling tasks without additional training. Existing methods rely primarily on Monte Carlo sampling with more particles, yet are premised on the pretrained model being exact. In practice, data and training limitations make the model imperfect, and these methods inherit its error. More particles reduce Monte Carlo error but cannot remove the mismatch between the endpoint and the desired target or the error in tracking the prescribed probability path. We introduce the Energy-based Feynman-Kac Corrector (EBFKC), a framework for energy-based diffusion models that corrects these errors on the fly given a reference energy. We first derive Feynman-Kac dynamics that track a prescribed path exactly in the continuous-time population limit even when the model is imperfect, and approximate these dynamics using sequential Monte Carlo with variance-controlling guidance. To remove the endpoint mismatch, we use the pretrained energy as a surrogate along the diffusion path and progressively incorporate the discrepancy between the learned and target terminal energies. Experiments on Gaussian mixture models, particle systems, alanine dipeptide, and alanine tetrapeptide show that our method closely matches target distributions and molecular free-energy profiles under annealing and reward tilting, whereas standard inference-time scaling baselines retain substantial sampling errors.

Steering diffusion models toward conditions unseen during training typically requires either retraining with conditional inputs or per-step gradient computations, both of which incur substantial computational overhead. We present Noise-Aligned RFM Steering (NA-RFM), a general recipe for efficiently steering diffusion models without gradient guidance during inference, enabling fast controllable generation. The method combines two offline-computed signals: noise alignment, a high-noise correction from PCA statistics of the target examples and the full data, and Recursive Feature Machine (RFM) activation steering, which learns a target-discriminative direction from labeled forward-process activations. During sampling, noise alignment provides coarse control at high noise, while the RFM direction is reused over intermediate/late timesteps through lightweight activation edits. Experiments on CIFAR-10, ImageNet, CelebA, and fine-grained bird species show improved target accuracy over gradient-based post-hoc guidance baselines, improved FID on the class-guidance benchmarks, and substantial inference speedups. Code: https://github.com/isotrivial/na-rfm.

Iterative sampling in diffusion models can lead to error accumulation due to exposure bias. The denoiser is trained on real images interpolated with noise, but at inference its inputs are constructed from its own imperfect predictions from the earlier steps, something it has never seen at training time. This might be one reason diffusion models often struggle without additional help, such as CFG. We introduce a correction step for diffusion models which attempts to reduce this training-inference gap. The corrector takes the base model's prediction as input and is trained against the same ground-truth target. This makes correction an explicit learning task, with training inputs provided by the base model. During sampling, at each denoising step, we iteratively refine the denoiser's clean-sample prediction. This allows us to correct predictions at intermediate denoising steps, preventing early artifacts from persisting into the final sample. Although the corrector is trained only on predictions from the base denoiser, it can be applied repeatedly to its own outputs at inference for better results. This simple framework leads to substantial improvement in sample quality while largely preserving diversity. We evaluate our method across DiT, SiT, and JiT. Our method substantially improves upon previously reported FID scores for unguided generation and, notably, unconditional generation, where producing high-quality samples without guidance has been particularly challenging. Our method achieves performance competitive with classifier-free guidance (CFG), and combining correction with CFG further improves diversity and reduces oversaturation typical of CFG. Finally, we show that the additional inference cost of correction can be amortized by distilling the refined predictions back into the base diffusion model, retaining the quality gains without additional inference-time overhead.