相关论文: Generating QM1B with PySCF$_{\text{IPU}}$

Progress in quantum computing hardware raises questions about how these devices can be controlled, programmed, and integrated with existing computational workflows. We briefly describe several prominent quantum computational models, their…

Despite the pursuit of quantum advantages in various applications, the power of quantum computers in neural network computations has mostly remained unknown, primarily due to a missing link that effectively designs a neural network model…

Recently, pre-trained foundation models have enabled significant advancements in multiple fields. In molecular machine learning, however, where datasets are often hand-curated, and hence typically small, the lack of datasets with labeled…

A lot of recent progress has been made in ultra low-bit quantization, promising significant improvements in latency, memory footprint and energy consumption on edge devices. Quantization methods such as Learned Step Size Quantization can…

The rapid development of large language models (LLM) has greatly enhanced everyday applications. While many FPGA-based accelerators, with flexibility for fine-grained data control, exhibit superior speed and energy efficiency compared to…

Mainstream machine-learning techniques such as deep learning and probabilistic programming rely heavily on sampling from generally intractable probability distributions. There is increasing interest in the potential advantages of using…

Supervised machine learning approaches have been increasingly used in accelerating electronic structure prediction as surrogates of first-principle computational methods, such as density functional theory (DFT). While numerous quantum…

Large Language Models have achieved strong performance on reasoning tasks, solving competition-level coding and math problems. However, their scalability is limited by human-labeled datasets and the lack of large-scale, challenging coding…

Large Language Models (LLMs) have showcased remarkable impacts across a wide spectrum of natural language processing tasks. Fine-tuning these pretrained models on downstream datasets provides further significant performance gains; however,…

Unsupervised vision clustering, a cornerstone in computer vision, has been studied for decades, yielding significant outcomes across numerous vision tasks. However, these algorithms involve substantial computational demands when confronted…

We design multi-horizon forecasting models for limit order book (LOB) data by using deep learning techniques. Unlike standard structures where a single prediction is made, we adopt encoder-decoder models with sequence-to-sequence and…

Abstract Modern image generation (IG) models have been shown to capture rich semantics valuable for image understanding (IU) tasks. However, the potential of IU models to improve IG performance remains uncharted. We address this issue using…

This paper reports the development of a Python Non-Uniform Fast Fourier Transform (PyNUFFT) package, which accelerates non-Cartesian image reconstruction on heterogeneous platforms. Scientific computing with Python encompasses a mature and…

Quantum machine learning has the potential to computationally outperform classical machine learning, but it is not yet clear whether it will actually be valuable for practical problems. While some artificial scenarios have shown that…

Missing data presents a critical challenge in real-world datasets, significantly degrading the performance of machine learning models. While Large Language Models (LLMs) have recently demonstrated remarkable capabilities in tabular data…

Artificial neural networks have achieved great success in many fields ranging from image recognition to video understanding. However, its high requirements for computing and memory resources have limited further development on processing…

The instantaneous quantum polynomial (IQP) quantum circuit Born machine (QCBM) has been proposed as a promising quantum generative model over bitstrings. Recent works have shown that the training of IQP-QCBM is classically tractable w.r.t.…

The availability of large-scale datasets on which to train, benchmark and test algorithms has been central to the rapid development of machine learning as a discipline and its maturity as a research discipline. Despite considerable…

The Adiabatic Quantum-Flux-Parametron (AQFP) superconducting technology has been recently developed, which achieves the highest energy efficiency among superconducting logic families, potentially huge gain compared with state-of-the-art…

Current quantum systems have significant limitations affecting the processing of large datasets with high dimensionality, typical of high energy physics. In the present paper, feature and data prototype selection techniques were studied to…