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Variational Auto-encoders (VAEs) are deep generative latent variable models consisting of two components: a generative model that captures a data distribution p(x) by transforming a distribution p(z) over latent space, and an inference…

Machine Learning · Computer Science 2022-08-25 Yaniv Yacoby , Weiwei Pan , Finale Doshi-Velez

This paper presents a simulator-assisted training method (SimVAE) for variational autoencoders (VAE) that leads to a disentangled and interpretable latent space. Training SimVAE is a two-step process in which first a deep generator…

Machine Learning · Statistics 2019-11-20 Akash Srivastava , Jessie Rosenberg , Dan Gutfreund , David D. Cox

A key advance in learning generative models is the use of amortized inference distributions that are jointly trained with the models. We find that existing training objectives for variational autoencoders can lead to inaccurate amortized…

Machine Learning · Computer Science 2018-05-31 Shengjia Zhao , Jiaming Song , Stefano Ermon

Extracting compact, physically interpretable representations from high-dimensional scientific data is a persistent challenge due to the complex, nonlinear structures inherent in physical systems. We propose a Gaussian Mixture Variational…

Machine Learning · Computer Science 2025-12-01 Tiffany Fan , Murray Cutforth , Marta D'Elia , Alexandre Cortiella , Alireza Doostan , Eric Darve

This work presents a data-driven framework for fast forward and inverse analysis in topology optimization (TO) by combining Rank Reduction Autoencoders (RRAEs) with neural latent-space mappings. The methodology targets the efficient…

The decoder-based machine learning generative algorithms such as Generative Adversarial Networks (GAN), Variational Auto-Encoders (VAE), Transformers show impressive results when constructing objects similar to those in a training ensemble.…

Computer Vision and Pattern Recognition · Computer Science 2024-02-20 Gabriel Turinici

This thesis is a proof of concept for the potential of Variational Auto-Encoder (VAE) on representation learning of real-world Knowledge Graphs (KG). Inspired by successful approaches to the generation of molecular graphs, we evaluate the…

Machine Learning · Computer Science 2021-01-25 Florian Wolf

To address the challenges in learning deep generative models (e.g.,the blurriness of variational auto-encoder and the instability of training generative adversarial networks, we propose a novel deep generative model, named…

Machine Learning · Computer Science 2019-02-26 Shunkang Zhang , Yuan Gao , Yuling Jiao , Jin Liu , Yang Wang , Can Yang

Inverse design in nanophotonics remains challenging due to its ill-posed nature and sensitivity to input inaccuracies. We present a novel framework that combines a Conditional Variational Autoencoder (CVAE) with a tandem network, enabling…

Optics · Physics 2025-07-22 Yuxiao Li , Taeyoon Kim , Allen Zhang , Zengbo Wang , Yongmin Liu

We introduce a novel variational autoencoder (VAE) architecture that can generate realistic and diverse high energy physics events. The model we propose utilizes several techniques from VAE literature in order to simulate high fidelity jet…

High Energy Physics - Phenomenology · Physics 2020-09-11 Kosei Dohi

Modern generative models are usually designed to match target distributions directly in the data space, where the intrinsic dimension of data can be much lower than the ambient dimension. We argue that this discrepancy may contribute to the…

Machine Learning · Computer Science 2020-07-02 Zijun Zhang , Ruixiang Zhang , Zongpeng Li , Yoshua Bengio , Liam Paull

This study introduces a compositional autoencoder (CAE) framework designed to disentangle the complex interplay between genotypic and environmental factors in high-dimensional phenotype data to improve trait prediction in plant breeding and…

Deep Neural Networks (DNNs) come into the limelight in High Energy Physics (HEP) in order to manipulate the increasing amount of data encountered in the next generation of accelerators. Recently, the HEP community has suggested Generative…

Quantum Physics · Physics 2021-01-28 Su Yeon Chang , Sofia Vallecorsa , Elías F. Combarro , Federico Carminati

Designing nuclear reactor cores requires navigating large discrete design spaces governed by complex neutronic interactions. Traditional deterministic, metaheuristic, and machine-learning-assisted methods search within fixed, human-defined…

Machine Learning · Computer Science 2025-12-19 Yoonpyo Lee

We investigate deep generative models that can exchange multiple modalities bi-directionally, e.g., generating images from corresponding texts and vice versa. Recently, some studies handle multiple modalities on deep generative models, such…

Machine Learning · Statistics 2016-11-08 Masahiro Suzuki , Kotaro Nakayama , Yutaka Matsuo

Recent work in synthetic data generation in the time-series domain has focused on the use of Generative Adversarial Networks. We propose a novel architecture for synthetically generating time-series data with the use of Variational…

Machine Learning · Computer Science 2021-12-08 Abhyuday Desai , Cynthia Freeman , Zuhui Wang , Ian Beaver

Ventilated acoustic resonator(VAR), a type of acoustic metamaterial, emerge as an alternative for sound attenuation in environments that require ventilation, owing to its excellent low-frequency attenuation performance and flexible shape…

Computational Engineering, Finance, and Science · Computer Science 2024-08-13 Min Woo Cho , Seok Hyeon Hwang , Jun-Young Jang , Jin Yeong Song , Sun-kwang Hwang , Kyoung Je Cha , Dong Yong Park , Kyungjun Song , Sang Min Park

Recent advances in generative models, particularly diffusion and auto-regressive models, have revolutionized fields like computer vision and natural language processing. However, their application to structure-based drug design (SBDD)…

Machine Learning · Computer Science 2025-07-29 Yi He , Ailun Wang , Zhi Wang , Yu Liu , Xingyuan Xu , Wen Yan

In this work, we present Multimodal Equivariant Inverse Design Network (MEIDNet), a framework that jointly learns structural information and materials properties through contrastive learning, while encoding structures via an equivariant…

Materials Science · Physics 2026-01-30 Anand Babu , Rogério Almeida Gouvêa , Pierre Vandergheynst , Gian-Marco Rignanese

The Variational Autoencoder (VAE) is a powerful framework for learning probabilistic latent variable generative models. However, typical assumptions on the approximate posterior distribution of the encoder and/or the prior, seriously…

Machine Learning · Computer Science 2020-07-13 Ifigeneia Apostolopoulou , Elan Rosenfeld , Artur Dubrawski