BioinformaticsbioRxivPreprint
Localized Reactivity on Protein as Riemannian Manifolds: A Geometric and Quantum-Inspired Basis for Deterministic, Metal-Aware Reactive-Site Prediction
The paper introduces a geometric and quantum-inspired framework for predicting reactive sites in proteins, achieving high accuracy in interface classification and functional pocket detection.
DOI 10.1101/2025.04.29.651260