Optimal Mixture-of-Experts Model Averaging for Conditional Generative Models
Authors: Shijin Gong, Baihua He, Xinyu Zhang
Organizations: School of Management, University of Science and Technology of China · Academy of Mathematics and Systems Science, Chinese Academy of Sciences
Abstract
Conditional generative models have emerged as powerful tools for sampling from target conditional distributions, driving substantial advances across a wide range of scientific and applied domains. As these models proliferate, practitioners often face multiple plausible generators whose performance can vary with the task, data, or input condition. We propose an optimal model averaging framework for conditional generative models, allowing candidate generators to be combined even when they are accessible only through conditional samples without tractable densities. Specifically, we use a sample-based maximum mean discrepancy between conditional distributions, which first leads to a static model averaging method, StaticMA, assigning fixed weights to different candidates. In addition, we develop MoEMA (mixture-of-experts model averaging), an input-adaptive method that parameterizes covariate-dependent weights through a softmax neural-network gate. We establish in-sample and out-of-sample asymptotic optimality for the proposed methods, together with consistency of the estimated adaptive weight function under regularity conditions. The framework applies directly to Euclidean responses and extends to unstructured data by combining our formulation with fixed representation maps. Across a broad set of simulations and real-data studies spanning tabular, image, and text modalities, MoEMA generally improves over competing baselines, demonstrating the effectiveness of our proposed methods.
Conditional generators provide a natural tool for controllable generation, including settings where the desired condition is a new composition of observed attributes or experimental factors. In many applications, especially in scientific domains, such models are attractive to explore conditions for which real samples are rare, expensive, or not yet observed. However, this creates a circularity for evaluation: standard conditional quality metrics require a reference target distribution, but in the extrapolative regime that distribution is unavailable by definition. We address this problem with a post-hoc, per-sample trust score for assessing conditional samples using only the training distribution. The score combines two estimable quantities: global realism, measuring compatibility with the real data manifold, and attribute-wise faithfulness, measuring whether a sample is closer to the requested attributes than to plausible alternatives. We show that the score can recover meaningful comparisons across extrapolated generations, under a mild coverage condition on the observed attributes. These comparisons enable effective filtering, ranking, and abstention of generations and can be used directly on off-the-shelf pretrained models. In biological imaging, selected samples preserve real morphological structure better and improve downstream predictive performance, while similar gains are observed on controlled vision benchmarks. Finally, we show how the score can be applied during generation, enabling abstention before full decoding. Code is available at https://github.com/berkerdemirel/faithful-cond-gen.
Berker Demirel, Valentino Maiorca, Marco Fumero +2
Generative Marginalization Models (MaMs) have been recently introduced as efficient neural sampling models for any-order autoregressive modelling of discrete distributions. By learning both the marginal and conditional probabilities of a persistent-block Gibbs sampler, MaMs enable fast posterior evaluation with a single neural network forward pass. While prior work has considered MaMs to be distinct from Generative Flow Networks (GFlowNets), a well-established paradigm for inference in discrete stochastic models, we show that they are equivalent. Then, we also extend MaMs' sampling strategy to non-autoregressive generative processes. In particular, we describe an automatic criterion for full-state rejuvenation of the Gibbs sampler, derived from the Gelman-Rubin statistic, which plays a key role in speeding up learning convergence. Our experiments show that our method, called Particle GFlowNets, markedly accelerates training in large combinatorial spaces.
Sampling from distributions conditioned on desired semantic properties is an emerging challenge in modern generative modeling. Metropolis-Hastings (MH) provides a principled route to conditional sampling, but requires access to exact pointwise target-density evaluations, which are not available in generative settings. Meanwhile, pairwise comparisons by humans or model "judge" are highly accessible and have proved valuable across diverse applications. We introduce Pref-MH, a general exact MH sampler for judge-induced conditional distributions using only stochastic binary pairwise comparisons. Our key observation is that the MH unnormalized density ratio matches the preference odds of the Bradley-Terry (BT) choice model. The central challenge is that while MH requires precise ratio computation, BT judges provide only sampled binary feedback. To this end, we develop a valid accept/reject rule whose resulting Markov chain provably converges to the target distribution. We further show that, for a fixed proposal kernel and budget, Pref-MH is optimal in the Peskun-Tierney sense among this class of exact reversible acceptance rules. Experiments on text generation and molecular design with LLM judges, as well as image generation with VLM judges, demonstrate that Pref-MH provides a practical and flexible approach to conditional sampling when comparative feedback is relatively easy to obtain.