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Related papers: Free Energy Mixer

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The constrained energy minimization (CEM) and matched filter (MF) are two most frequently used target detection algorithms in the remotely sensed community. In this paper, we first introduce an augmented CEM (ACEM) by adding an all-one…

Methodology · Statistics 2016-12-05 Xiurui Geng , Luyan Ji , Weitun Yang , Fuxiang Wang , Yongchao Zhao

The realization of a standard Adaptive Finite Element Method (AFEM) preserves the mesh conformity by performing a completion step in the refinement loop: in addition to elements marked for refinement due to their contribution to the global…

Numerical Analysis · Mathematics 2024-02-15 Claudio Canuto , Davide Fassino

Feedforward models for novel view synthesis (NVS) have recently advanced by transformer-based methods like LVSM, using attention among all input and target views. In this work, we argue that its full self-attention design is suboptimal,…

Computer Vision and Pattern Recognition · Computer Science 2026-02-09 Xiaosong Jia , Yihang Sun , Junqi You , Songbur Wong , Zichen Zou , Junchi Yan , Zuxuan Wu , Yu-Gang Jiang

Standard transformer attention computes pairwise similarity between queries and keys, treating all tokens as equally salient regardless of their intrinsic informational content. In turbulent fluid dynamics, coherent structures -- the…

Machine Learning · Computer Science 2026-05-22 Athanasios Zeris

We propose a simple modification to the conventional attention mechanism applied by Transformers: Instead of quantifying pairwise query-key similarity with scaled dot-products, we quantify it with the logarithms of scaled dot-products of…

Machine Learning · Computer Science 2024-04-30 Franz A. Heinsen

The Generalized Finite Element Method (GFEM) is an extension of the Finite Element Method (FEM), where the standard finite element space is augmented with a space of non-polynomial functions, called the enrichment space. The functions in…

Numerical Analysis · Mathematics 2016-03-30 Kenan Kergrene , Ivo Babuška , Uday Banerjee

We propose a Pretrained Finite Element Method (PFEM),a physics driven framework that bridges the efficiency of neural operator learning with the accuracy and robustness of classical finite element methods (FEM). PFEM consists of a physics…

Functional data play a pivotal role across science and engineering, yet their infinite-dimensional nature makes representation learning challenging. Conventional statistical models depend on pre-chosen basis expansions or kernels, limiting…

Machine Learning · Computer Science 2025-10-02 Yifei Gao , Yong Chen , Chen Zhang

We present a new method to compute free energies at a quantum mechanical (QM) level of theory from molecular simulations using cheap reference potential energy functions, such as force fields. To overcome the poor overlap between the…

Computational Physics · Physics 2023-11-13 Andrea Rizzi , Paolo Carloni , Michele Parrinello

We present an approach that extends the theory of targeted free energy perturbation (TFEP) to calculate free energy differences and free energy surfaces at an accurate quantum mechanical level of theory from a cheaper reference potential.…

Computational Physics · Physics 2021-11-15 Andrea Rizzi , Paolo Carloni , Michele Parrinello

Standard transformer attention computes pairwise token similarity but treats all tokens as equally salient and all positions as equally local, regardless of the informational structure of the input. We identify two complementary inductive…

Machine Learning · Computer Science 2026-05-27 Athanasios Zeris

Linear attention has emerged as a promising alternative to softmax-based attention, leveraging kernelized feature maps to reduce complexity from quadratic to linear in sequence length. However, the non-negative constraint on feature maps…

Computer Vision and Pattern Recognition · Computer Science 2025-03-05 Weikang Meng , Yadan Luo , Xin Li , Dongmei Jiang , Zheng Zhang

Free energy perturbation (FEP) is frequently used to evaluate the free energy change of a biological process, e.g. the drug binding free energy or the ligand solvation free energy. Due to the sampling inefficiency, FEP is often employed…

Chemical Physics · Physics 2017-01-31 Ying-Chih Chiang , Frank Otto

Semantic communication (SemCom), regarded as the evolution of the traditional Shannon's communication model, stresses the transmission of semantic information instead of the data itself. Federated learning (FL), owing to its distributed…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-03-11 Xinyu Zhou , Yang Li , Jun Zhao

Score matching (SM) provides a compelling approach to learn energy-based models (EBMs) by avoiding the calculation of partition function. However, it remains largely open to learn energy-based latent variable models (EBLVMs), except some…

Machine Learning · Computer Science 2020-10-19 Fan Bao , Chongxuan Li , Kun Xu , Hang Su , Jun Zhu , Bo Zhang

We introduce a novel hybrid methodology combining classical finite element methods (FEM) with neural networks to create a well-performing and generalizable surrogate model for forward and inverse problems. The residual from finite element…

Computational Engineering, Finance, and Science · Computer Science 2022-05-18 Rishith Ellath Meethal , Birgit Obst , Mohamed Khalil , Aditya Ghantasala , Anoop Kodakkal , Kai-Uwe Bletzinger , Roland Wüchner

We introduce Attention Free Transformer (AFT), an efficient variant of Transformers that eliminates the need for dot product self attention. In an AFT layer, the key and value are first combined with a set of learned position biases, the…

Machine Learning · Computer Science 2021-09-23 Shuangfei Zhai , Walter Talbott , Nitish Srivastava , Chen Huang , Hanlin Goh , Ruixiang Zhang , Josh Susskind

Data mixing methods play a crucial role in semi-supervised learning (SSL), but their application is unexplored in long-tailed semi-supervised learning (LTSSL). The primary reason is that the in-batch mixing manner fails to address class…

Computer Vision and Pattern Recognition · Computer Science 2024-04-02 Hongwei Zheng , Linyuan Zhou , Han Li , Jinming Su , Xiaoming Wei , Xiaoming Xu

Linear attention methods offer Transformers $O(N)$ complexity but typically underperform standard softmax attention. We identify two fundamental limitations affecting these approaches: the restriction to convex combinations that only…

Machine Learning · Computer Science 2026-02-06 Jiecheng Lu , Xu Han , Yan Sun , Viresh Pati , Yubin Kim , Siddhartha Somani , Shihao Yang

We propose Energy-based generator matching (EGM), a modality-agnostic approach to train generative models from energy functions in the absence of data. Extending the recently proposed generator matching, EGM enables training of arbitrary…

Machine Learning · Computer Science 2025-11-20 Dongyeop Woo , Minsu Kim , Minkyu Kim , Kiyoung Seong , Sungsoo Ahn