Wei Hu

25PUBLICATIONS
44CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsNonlinear optics and spectroscopyTheoretical quantum chemistryElemental semiconductorsComputational chemistry
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Publications (25)

|Oct 28, 2025
Multimodal Machine Learning for Molecular Identification Based on IR, Raman, and NMR Spectra.

Sheng Wu, Shengjiao Ji, Mingzhi Yuan

|Aug 26, 2025
Constructing NIR-II Fluorophores with Enhanced Fluorescence Quantum Efficiency via Asymmetric D-A-D' Molecular Architectures.

Lingling Dong, Jing Zhang, Wei Hu

|Jul 23, 2025
Deep Learning for Bidirectional Translation between Molecular Structures and Vibrational Spectra.

Tianqing Hu, Zihan Zou, Bo Li

|Jun 16, 2025
Modulating Electronic Properties with sp-N Incorporation in Co-N-C Catalyst for Enhanced Performance in Zinc-Air Batteries.

Shuai Wang, Yuqi Chen, Shuyan Zheng

|Apr 14, 2025
QMe14S: A Comprehensive and Efficient Spectral Data Set for Small Organic Molecules.

Mingzhi Yuan, Zihan Zou, Yi Luo

|Feb 18, 2025
Deep Learning Protocol for Predicting Full-Spectrum Infrared and Raman Spectra of Polypeptides and Proteins Using All-Atom Models.

Xiaochen Yang, Xun Zhang, Yujin Zhang

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