Author

Wenjie Du

h-index 5 View on Semantic Scholar

We have 2 of 12 papers

We haven’t gathered this author’s papers yet. Follow them and we’ll fetch their work.

Not the right person? Other researchers publish under this name.

Jul 2026

SpecCal: Ambiguity-Aware Candidate Calibration for Infrared Spectrum-Based Molecular Structure Reconstruction

Inferring molecular structures from infrared (IR) spectra is a fundamental yet challenging problem. A key difficulty is that an IR spectrum provides limited structural information: different molecules may share similar functional groups and local vibrational patterns, leading to highly similar spectral responses. Thus,...

Yixuan Chen, Bo Liu, Yu-Sen Tan et al. · arXiv.org · 0 citations

Preprint Aug 2026

Towards Reasonable Molecular Structure Elucidation from Infrared Spectroscopy with Chemical Feedback

Infrared (IR) spectra provide characteristic signals of molecular structure, which are often interpreted by experts via functional-group identification or library matching, making the process time-consuming and ambiguous. Recent machine learning methods have made progress in molecular structure elucidation using molecu...

Yusen Tan, Hongyu Zhan, Hai-tao Yu et al. · 0 citations