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深度学习及其在核磁共振波谱学中的应用。

Deep learning and its applications in nuclear magnetic resonance spectroscopy.

作者信息

Luo Yao, Zheng Xiaoxu, Qiu Mengjie, Gou Yaoping, Yang Zhengxian, Qu Xiaobo, Chen Zhong, Lin Yanqin

机构信息

Fujian Provincial Key Laboratory of Plasma and Magnetic Resonance, Department of Electronic Science, State Key Laboratory of Physical Chemistry of Solid Surfaces, Xiamen University, Xiamen 361005, China.

Fujian Provincial Key Laboratory of Plasma and Magnetic Resonance, Department of Electronic Science, State Key Laboratory of Physical Chemistry of Solid Surfaces, Xiamen University, Xiamen 361005, China.

出版信息

Prog Nucl Magn Reson Spectrosc. 2025 Apr-Jun;146-147:101556. doi: 10.1016/j.pnmrs.2024.101556. Epub 2025 Jan 17.

Abstract

Nuclear Magnetic Resonance (NMR), as an advanced technology, has widespread applications in various fields like chemistry, biology, and medicine. However, issues such as long acquisition times for multidimensional spectra and low sensitivity limit the broader application of NMR. Traditional algorithms aim to address these issues but have limitations in speed and accuracy. Deep Learning (DL), a branch of Artificial Intelligence (AI) technology, has shown remarkable success in many fields including NMR. This paper presents an overview of the basics of DL and current applications of DL in NMR, highlights existing challenges, and suggests potential directions for improvement.

摘要

核磁共振(NMR)作为一项先进技术,在化学、生物学和医学等各个领域有着广泛的应用。然而,多维谱采集时间长和灵敏度低等问题限制了NMR的更广泛应用。传统算法旨在解决这些问题,但在速度和准确性方面存在局限性。深度学习(DL)是人工智能(AI)技术的一个分支,在包括NMR在内的许多领域都取得了显著成功。本文概述了DL的基础知识及其在NMR中的当前应用,突出了现有挑战,并提出了潜在的改进方向。

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