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Learning Signal-Agnostic Manifolds of Neural Fields

Neural Information Processing Systems

Deep neural networks have been used widely to learn the latent structure of datasets, across modalities such as images, shapes, and audio signals. However, existing models are generally modality-dependent, requiring custom architectures and objectives to process different classes of signals. We leverage neural fields to capture the underlying structure in image, shape, audio and cross-modal audiovisual domains in a modality-independent manner. We cast our task as one of learning a manifold, where we aim to infer a low-dimensional, locally linear subspace in which our data resides. By enforcing coverage of the manifold, local linearity, and local isometry, our model -- dubbed GEM -- learns to capture the underlying structure of datasets across modalities. We can then travel along linear regions of our manifold to obtain perceptually consistent interpolations between samples, and can further use GEM to recover points on our manifold and glean not only diverse completions of input images, but cross-modal hallucinations of audio or image signals. Finally, we show that by walking across the underlying manifold of GEM, we may generate new samples in our signal domains.


Generalization Beyond Benchmarks: Evaluating Learnable Protein-Ligand Scoring Functions on Unseen Targets

Kopko, Jakub, Graber, David, Eyrilmez, Saltuk Mustafa, Mazurenko, Stanislav, Bednar, David, Sedlar, Jiri, Sivic, Josef

arXiv.org Artificial Intelligence

As machine learning becomes increasingly central to molecular design, it is vital to ensure the reliability of learnable protein-ligand scoring functions on novel protein targets. While many scoring functions perform well on standard benchmarks, their ability to generalize beyond training data remains a significant challenge. In this work, we evaluate the generalization capability of state-of-the-art scoring functions on dataset splits that simulate evaluation on targets with a limited number of known structures and experimental affinity measurements. Our analysis reveals that the commonly used benchmarks do not reflect the true challenge of generalizing to novel targets. We also investigate whether large-scale self-supervised pretraining can bridge this generalization gap and we provide preliminary evidence of its potential. Furthermore, we probe the efficacy of simple methods that leverage limited test-target data to improve scoring function performance. Our findings underscore the need for more rigorous evaluation protocols and offer practical guidance for designing scoring functions with predictive power extending to novel protein targets.


GEM: Gaussian Embedding Modeling for Out-of-Distribution Detection in GUI Agents

Wu, Zheng, Cheng, Pengzhou, Wu, Zongru, Dong, Lingzhong, Zhang, Zhuosheng

arXiv.org Artificial Intelligence

Graphical user interface (GUI) agents have recently emerged as an intriguing paradigm for human-computer interaction, capable of automatically executing user instructions to operate intelligent terminal devices. However, when encountering out-of-distribution (OOD) instructions that violate environmental constraints or exceed the current capabilities of agents, GUI agents may suffer task breakdowns or even pose security threats. Therefore, effective OOD detection for GUI agents is essential. Traditional OOD detection methods perform suboptimally in this domain due to the complex embedding space and evolving GUI environments. In this work, we observe that the in-distribution input semantic space of GUI agents exhibits a clustering pattern with respect to the distance from the centroid. Based on the finding, we propose GEM, a novel method based on fitting a Gaussian mixture model over input embedding distances extracted from the GUI agent that reflect its capability boundary. Evaluated on eight datasets spanning smartphones, computers, and web browsers, our method achieves an average accuracy improvement of 23.70\% over the best-performing baseline while only increasing training time by 4.9\% and testing time by 6.5\%. We also experimentally demonstrate that GEM can improve the step-wise success rate by 9.40\% by requesting assistance from the cloud model when encountering OOD samples. Analysis verifies the generalization ability of our method through experiments on nine different backbones. The codes are available at https://github.com/Wuzheng02/GEM-OODforGUIagents.



GEM: Generative Entropy-Guided Preference Modeling for Few-shot Alignment of LLMs

Zhao, Yiyang, Bai, Huiyu, Zhao, Xuejiao

arXiv.org Artificial Intelligence

Alignment of large language models (LLMs) with human preferences typically relies on supervised reward models or external judges that demand abundant annotations. However, in fields that rely on professional knowledge, such as medicine and law, such large-scale preference labels are often unachievable. In this paper, we propose a generative entropy-guided preference modeling approach named GEM for LLMs aligment at low-resource and domain-specific scenarios. Instead of training a discriminative reward model on preference data, we directly train the LLM to internalize a closed-loop optimization architecture that can extract and exploit the multi-dimensional, fine-grained cognitive signals implicit in human preferences. Specifically, our Cognitive Filtering module, based on entropy theory in decision making, first leverages Chain-of-Thought (CoT) prompting to generate diverse candidate reasoning chains (CoTs) from preference data. Subsequently, it introduces a token scoring mechanism to rank and weight the sampled CoTs, boosting the importance of high-confidence answers and strategically high-entropy tokens. Building on these filtered preferences, we fine-tune the LLM using a novel self-evaluated group advantage algorithm, SEGA, which effectively aggregates group-level cognitive signals and transforms the entropy-based scores into implicit rewards for policy optimization. In these ways, GEM empowers the LLM to rely on its own judgments and establishes an entropy-guided closed-loop cognitive optimization framework, enabling highly efficient few-shot alignment of LLMs. Experiments on general benchmarks and domain-specific tasks (such as mathematical reasoning and medical dialogues) demonstrate that our GEM achieves significant improvements with few-shot preference data.


GEM+: Scalable State-of-the-Art Private Synthetic Data with Generator Networks

Maddock, Samuel, Gade, Shripad, Cormode, Graham, Bullock, Will

arXiv.org Artificial Intelligence

State-of-the-art differentially private synthetic tabular data has been defined by adaptive 'select-measure-generate' frameworks, exemplified by methods like AIM. These approaches iteratively measure low-order noisy marginals and fit graphical models to produce synthetic data, enabling systematic optimisation of data quality under privacy constraints. Graphical models, however, are inefficient for high-dimensional data because they require substantial memory and must be retrained from scratch whenever the graph structure changes, leading to significant computational overhead. Recent methods, like GEM, overcome these limitations by using generator neural networks for improved scalability. However, empirical comparisons have mostly focused on small datasets, limiting real-world applicability. In this work, we introduce GEM+, which integrates AIM's adaptive measurement framework with GEM's scalable generator network. Our experiments show that GEM+ outperforms AIM in both utility and scalability, delivering state-of-the-art results while efficiently handling datasets with over a hundred columns, where AIM fails due to memory and computational overheads.