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In recent years, deep generative models have been successfully adopted for various molecular design tasks, particularly in the life and material sciences. A critical challenge for pre-trained generative molecular design (GMD) models is to…

机器学习 · 计算机科学 2024-06-03 A N M Nafiz Abeer , Sanket Jantre , Nathan M Urban , Byung-Jun Yoon

Deep generative models have been wildly successful at learning coherent latent representations for continuous data such as video and audio. However, generative modeling of discrete data such as arithmetic expressions and molecular…

机器学习 · 统计学 2017-03-07 Matt J. Kusner , Brooks Paige , José Miguel Hernández-Lobato

Generative modeling aims to generate new data samples that resemble a given dataset, with diffusion models recently becoming the most popular generative model. One of the main challenges of diffusion models is solving the problem in the…

数值分析 · 数学 2025-10-08 Wonjun Lee , Riley C. W. O'Neill , Dongmian Zou , Jeff Calder , Gilad Lerman

We present a syntax-infused variational autoencoder (SIVAE), that integrates sentences with their syntactic trees to improve the grammar of generated sentences. Distinct from existing VAE-based text generative models, SIVAE contains two…

机器学习 · 统计学 2019-06-11 Xinyuan Zhang , Yi Yang , Siyang Yuan , Dinghan Shen , Lawrence Carin

Traditional computational authorship attribution describes a classification task in a closed-set scenario. Given a finite set of candidate authors and corresponding labeled texts, the objective is to determine which of the authors has…

机器学习 · 计算机科学 2020-05-29 Benedikt Boenninghoff , Steffen Zeiler , Robert M. Nickel , Dorothea Kolossa

Multiple modalities often co-occur when describing natural phenomena. Learning a joint representation of these modalities should yield deeper and more useful representations. Previous generative approaches to multi-modal input either do not…

机器学习 · 计算机科学 2018-11-13 Mike Wu , Noah Goodman

Deep learning on graphs has become a popular research topic with many applications. However, past work has concentrated on learning graph embedding tasks, which is in contrast with advances in generative models for images and text. Is it…

机器学习 · 计算机科学 2018-02-13 Martin Simonovsky , Nikos Komodakis

Hierarchical Bayesian methods can unify many related tasks (e.g. k-shot classification, conditional and unconditional generation) as inference within a single generative model. However, when this generative model is expressed as a powerful…

机器学习 · 计算机科学 2018-07-25 Luke B. Hewitt , Maxwell I. Nye , Andreea Gane , Tommi Jaakkola , Joshua B. Tenenbaum

Image generation has advanced rapidly over the past decade, yet the literature seems fragmented across different models and application domains. This paper aims to offer a comprehensive survey of breakthrough image generation models,…

计算机视觉与模式识别 · 计算机科学 2026-03-31 Rouzbeh Shirvani

Recent research has shown the advantages of using autoencoders based on deep neural networks for collaborative filtering. In particular, the recently proposed Mult-VAE model, which used the multinomial likelihood variational autoencoders,…

信息检索 · 计算机科学 2019-12-25 Ilya Shenbin , Anton Alekseev , Elena Tutubalina , Valentin Malykh , Sergey I. Nikolenko

Variational autoencoders (VAEs) are widely used deep generative models capable of learning unsupervised latent representations of data. Such representations are often difficult to interpret or control. We consider the problem of…

机器学习 · 计算机科学 2018-12-18 Jack Klys , Jake Snell , Richard Zemel

We introduce a novel generative autoencoder network model that learns to encode and reconstruct images with high quality and resolution, and supports smooth random sampling from the latent space of the encoder. Generative adversarial…

机器学习 · 计算机科学 2018-10-10 Ari Heljakka , Arno Solin , Juho Kannala

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…

机器学习 · 计算机科学 2018-05-31 Shengjia Zhao , Jiaming Song , Stefano Ermon

The vector quantization is a widely used method to map continuous representation to discrete space and has important application in tokenization for generative mode, bottlenecking information and many other tasks in machine learning. Vector…

机器学习 · 计算机科学 2024-10-15 Mingyuan Yan , Jiawei Wu , Rushi Shah , Dianbo Liu

While unsupervised variational autoencoders (VAE) have become a powerful tool in neuroimage analysis, their application to supervised learning is under-explored. We aim to close this gap by proposing a unified probabilistic model for…

机器学习 · 计算机科学 2019-07-15 Qingyu Zhao , Ehsan Adeli , Nicolas Honnorat , Tuo Leng , Kilian M. Pohl

Generative modelling of multi-user datasets has become prominent in science and engineering. Generating a data point for a given user requires employing user information, and conventional generative models, including variational…

机器学习 · 计算机科学 2026-05-19 Kutay Bölat , Simon Tindemans

To address the lack of public power system data for machine learning research in energy networks, we investigate the use of variational graph autoencoders (VGAEs) for synthetic distribution grid generation. Using two open-source datasets,…

机器学习 · 计算机科学 2025-12-02 Syed Zain Abbas , Ehimare Okoyomon

The variational autoencoder (VAE) framework is a popular option for training unsupervised generative models, featuring ease of training and latent representation of data. The objective function of VAE does not guarantee to achieve the…

机器学习 · 计算机科学 2019-04-25 Jason Chou

Variational autoencoders (VAEs) are deep probabilistic models that are used in scientific applications. Many works try to mitigate this problem from the probabilistic methods perspective by new inference techniques or training procedures.…

机器学习 · 统计学 2024-12-24 Tim Z. Xiao , Johannes Zenn , Robert Bamler

Variational Autoencoders (VAE) are popular generative models used to sample from complex data distributions. Despite their empirical success in various machine learning tasks, significant gaps remain in understanding their theoretical…

机器学习 · 统计学 2025-12-23 Sobihan Surendran , Antoine Godichon-Baggioni , Sylvain Le Corff