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相关论文: Implicit Generation and Generalization in Energy-B…

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Implicit generative models are difficult to train as no explicit density functions are defined. Generative adversarial nets (GANs) present a minimax framework to train such models, which however can suffer from mode collapse due to the…

机器学习 · 计算机科学 2020-06-25 Chao Du , Kun Xu , Chongxuan Li , Jun Zhu , Bo Zhang

Molecules in equilibrium follow a Boltzmann distribution, making the underlying energy landscape a physically grounded modeling objective. However, such landscapes are difficult to learn from data and, once learned, hard to sample from.…

机器学习 · 计算机科学 2026-05-19 Christoph Griesbacher , Lea Bogensperger , Andreas Habring , Thomas Pock

Generative adversarial networks (GANs) provide an algorithmic framework for constructing generative models with several appealing properties: they do not require a likelihood function to be specified, only a generating procedure; they…

机器学习 · 统计学 2017-02-28 Shakir Mohamed , Balaji Lakshminarayanan

Retrosynthesis -- the process of identifying a set of reactants to synthesize a target molecule -- is of vital importance to material design and drug discovery. Existing machine learning approaches based on language models and graph neural…

化学物理 · 物理学 2021-12-10 Ruoxi Sun , Hanjun Dai , Li Li , Steven Kearnes , Bo Dai

For speech classification tasks, deep learning models often achieve high accuracy but exhibit shortcomings in calibration, manifesting as classifiers exhibiting overconfidence. The significance of calibration lies in its critical role in…

音频与语音处理 · 电气工程与系统科学 2024-06-27 Yaqian Hao , Chenguang Hu , Yingying Gao , Shilei Zhang , Junlan Feng

Energy-Based Models (EBMs) have proven to be a highly effective approach for modelling densities on finite-dimensional spaces. Their ability to incorporate domain-specific choices and constraints into the structure of the model through…

机器学习 · 计算机科学 2023-02-24 Jen Ning Lim , Sebastian Vollmer , Lorenz Wolf , Andrew Duncan

We present energy-based generative flow networks (EB-GFN), a novel probabilistic modeling algorithm for high-dimensional discrete data. Building upon the theory of generative flow networks (GFlowNets), we model the generation process by a…

机器学习 · 计算机科学 2022-06-10 Dinghuai Zhang , Nikolay Malkin , Zhen Liu , Alexandra Volokhova , Aaron Courville , Yoshua Bengio

Existing methods, such as concept bottleneck models (CBMs), have been successful in providing concept-based interpretations for black-box deep learning models. They typically work by predicting concepts given the input and then predicting…

计算机视觉与模式识别 · 计算机科学 2025-01-03 Xinyue Xu , Yi Qin , Lu Mi , Hao Wang , Xiaomeng Li

Reward models (RMs) are essential for aligning Large Language Models (LLMs) with human preferences. However, they often struggle with capturing complex human preferences and generalizing to unseen data. To address these challenges, we…

计算与语言 · 计算机科学 2025-08-06 Anamika Lochab , Ruqi Zhang

Exponential random graph models (ERGMs) are very flexible for modeling network formation but pose difficult estimation challenges due to their intractable normalizing constant. Existing methods, such as MCMC-MLE, rely on sequential…

社会与信息网络 · 计算机科学 2025-02-05 Angelo Mele

This work studies the learning problem of the energy-based prior model and the multi-layer generator model. The multi-layer generator model, which contains multiple layers of latent variables organized in a top-down hierarchical structure,…

机器学习 · 计算机科学 2024-05-29 Jiali Cui , Tian Han

In this paper, we investigate the extrapolation capabilities of implicit deep learning models in handling unobserved data, where traditional deep neural networks may falter. Implicit models, distinguished by their adaptability in layer…

机器学习 · 计算机科学 2024-07-22 Juliette Decugis , Alicia Y. Tsai , Max Emerling , Ashwin Ganesh , Laurent El Ghaoui

Energy-based models (EBMs) provide an elegant framework for density estimation, but they are notoriously difficult to train. Recent work has established links to generative adversarial networks, where the EBM is trained through a minimax…

机器学习 · 计算机科学 2021-11-03 Cong Geng , Jia Wang , Zhiyong Gao , Jes Frellsen , Søren Hauberg

Global Autoregressive Models (GAMs) are a recent proposal [Parshakova et al., CoNLL 2019] for exploiting global properties of sequences for data-efficient learning of seq2seq models. In the first phase of training, an Energy-Based model…

机器学习 · 计算机科学 2019-12-19 Tetiana Parshakova , Jean-Marc Andreoli , Marc Dymetman

Exponential random graph models (ERGMs) are a widely used framework for network data, enabling hypothesis testing on the structural mechanisms underlying observed networks. Bayesian ERGMs provide principled uncertainty quantification and…

统计方法学 · 统计学 2026-05-26 Alberto Caimo , Isabella Gollini

Energy-based language models (ELMs) parameterize an unnormalized distribution for natural sentences and are radically different from popular autoregressive language models (ALMs). As an important application, ELMs have been successfully…

计算与语言 · 计算机科学 2023-05-30 Hong Liu , Zhaobiao Lv , Zhijian Ou , Wenbo Zhao , Qing Xiao

Explainable boosting machines (EBMs) are popular "glass-box" models that learn a set of univariate functions using boosting trees. These achieve explainability through visualizations of each feature's effect. However, unlike linear model…

机器学习 · 统计学 2026-03-31 Haimo Fang , Kevin Tan , Jonathan Pipping-Gamon , Giles Hooker

In this work, we explore joint energy-based model (EBM) training during the finetuning of pretrained text encoders (e.g., Roberta) for natural language understanding (NLU) tasks. Our experiments show that EBM training can help the model…

计算与语言 · 计算机科学 2021-02-22 Tianxing He , Bryan McCann , Caiming Xiong , Ehsan Hosseini-Asl

This study investigates the effects of Markov chain Monte Carlo (MCMC) sampling in unsupervised Maximum Likelihood (ML) learning. Our attention is restricted to the family of unnormalized probability densities for which the negative log…

机器学习 · 统计学 2019-12-02 Erik Nijkamp , Mitch Hill , Tian Han , Song-Chun Zhu , Ying Nian Wu

Fine-grained open-set recognition (FineOSR) aims to recognize images belonging to classes with subtle appearance differences while rejecting images of unknown classes. A recent trend in OSR shows the benefit of generative models to…

计算机视觉与模式识别 · 计算机科学 2023-10-31 Wentao Bao , Qi Yu , Yu Kong