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With the recent advances in machine learning for quantum chemistry, it is now possible to predict the chemical properties of compounds and to generate novel molecules. Existing generative models mostly use a string- or graph-based…

Biomolecules · Quantitative Biology 2020-10-14 Vitali Nesterov , Mario Wieser , Volker Roth

Generative models realized with machine learning techniques are powerful tools to infer complex and unknown data distributions from a finite number of training samples in order to produce new synthetic data. Diffusion models are an emerging…

Quantum Physics · Physics 2024-07-18 Marco Parigi , Stefano Martina , Filippo Caruso

Restricted Boltzmann machines (RBMs) and their extensions, called 'deep-belief networks', are powerful neural networks that have found applications in the fields of machine learning and artificial intelligence. The standard way to training…

Machine Learning · Computer Science 2018-10-25 Haik Manukian , Fabio L. Traversa , Massimiliano Di Ventra

We propose a hybrid quantum-classical approach to model continuous classical probability distributions using a variational quantum circuit. The architecture of the variational circuit consists of two parts: a quantum circuit employed to…

Quantum Physics · Physics 2019-01-04 Jonathan Romero , Alan Aspuru-Guzik

Existing drug discovery pipelines take 5-10 years and cost billions of dollars. Computational approaches aim to sample from regions of the whole molecular and solid-state compounds called chemical space which could be on the order of 1060 .…

Emerging Technologies · Computer Science 2021-01-12 Junde Li , Rasit Topaloglu , Swaroop Ghosh

Machine Learning has been applied in a wide range of tasks throughout the last years, ranging from image classification to autonomous driving and natural language processing. Restricted Boltzmann Machine (RBM) has received recent attention…

Machine Learning · Computer Science 2021-01-05 Gustavo H. de Rosa , Mateus Roder , João P. Papa

The rapid growth of computer vision and increasingly complex image recognition tasks has exposed fundamental computational limitations of classical machine learning models, motivating the exploration of quantum computing as an emerging new…

Computer Vision and Pattern Recognition · Computer Science 2026-05-28 Sudip Vhaduri , Ryan Gammon , Sayanton Dibbo

We propose a higher-level associative memory for learning adversarial networks. Generative adversarial network (GAN) framework has a discriminator and a generator network. The generator (G) maps white noise (z) to data samples while the…

Machine Learning · Computer Science 2016-11-23 Tarik Arici , Asli Celikyilmaz

Graphical models are powerful tools for modeling high-dimensional data, but learning graphical models in the presence of latent variables is well-known to be difficult. In this work we give new results for learning Restricted Boltzmann…

Machine Learning · Computer Science 2020-07-28 Surbhi Goel , Adam Klivans , Frederic Koehler

Generative adversarial networks (GANs) represent a powerful tool for classical machine learning: a generator tries to create statistics for data that mimics those of a true data set, while a discriminator tries to discriminate between the…

Quantum Physics · Physics 2018-07-31 Seth Lloyd , Christian Weedbrook

Quantum computers hold unprecedented potentials for machine learning applications. Here, we prove that physical quantum circuits are PAC (probably approximately correct) learnable on a quantum computer via empirical risk minimization: to…

Quantum Physics · Physics 2022-01-04 Haoyuan Cai , Qi Ye , Dong-Ling Deng

Boltzmann Machines constitute a class of neural networks with applications to image reconstruction, pattern classification and unsupervised learning in general. Their most common variants, called Restricted Boltzmann Machines (RBMs) exhibit…

Quantum Physics · Physics 2020-03-30 Lorenzo Rocutto , Claudio Destri , Enrico Prati

Quantum generative learning is a promising application of quantum computers, but faces several trainability challenges, including the difficulty in experimental gradient estimations. For certain structured quantum generative models,…

Quantum Physics · Physics 2025-11-19 Bence Bakó , Zoltán Kolarovszki , Zoltán Zimborás

In generative learning, models are trained to produce new samples that follow the distribution of the target data. These models were historically difficult to train, until proposals such as Generative Adversarial Networks (GANs) emerged,…

Quantum Physics · Physics 2025-01-08 Tigran Sedrakyan , Alexia Salavrakos

Quantum machine learning (QML) is an emerging field that investigates the capabilities of quantum computers for learning tasks. While QML models can theoretically offer advantages such as exponential speed-ups, challenges in data loading…

Quantum Physics · Physics 2025-11-03 Florian J. Kiwit , Bernhard Jobst , Andre Luckow , Frank Pollmann , Carlos A. Riofrío

We present hierarchical learning, a novel variational architecture for efficient training of large-scale variational quantum circuits. We test and benchmark our technique for distribution loading with quantum circuit born machines (QCBMs).…

Quantum Physics · Physics 2023-11-23 Hrant Gharibyan , Vincent Su , Hayk Tepanyan

Quantum machine learning (QML) requires powerful, flexible and efficiently trainable models to be successful in solving challenging problems. We introduce density quantum neural networks, a model family that prepares mixtures of trainable…

In this thesis we explore using the D-Wave Advantage 4.1 quantum annealer to sample from quantum Boltzmann distributions and train quantum Boltzmann machines (QBMs). We focus on the real-world problem of using QBMs as generative models to…

Quantum Physics · Physics 2023-02-01 Cameron Perot

Graphical models are a rich language for describing high-dimensional distributions in terms of their dependence structure. While there are algorithms with provable guarantees for learning undirected graphical models in a variety of…

Machine Learning · Computer Science 2018-11-07 Guy Bresler , Frederic Koehler , Ankur Moitra , Elchanan Mossel

Although several models have been proposed towards assisting machine learning (ML) tasks with quantum computers, a direct comparison of the expressive power and efficiency of classical versus quantum models for datasets originating from…

Quantum Physics · Physics 2020-01-09 Javier Alcazar , Vicente Leyton-Ortega , Alejandro Perdomo-Ortiz
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