most citedSpectra-to-Structure and Structure-to-Spectra Inference Across the Periodic Table

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q-bio.BM2025

XDIP: A Curated X-ray Absorption Spectrum Dataset for Iron-Containing Proteins

Yufeng Wang, Peiyao Wang, Lu Wei +6

Earth-abundant iron is an essential metal in regulating the structure and function of proteins. This study presents the development of a comprehensive X-ray Absorption Spectroscopy…