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60 Measurement Groups for 116-Qubit CYP3A4: A 134-Fold Improvement via locality-Aware Tabu-Colony Coloring

Year: 2026
Type: article
Abstract: The recent fault-tolerant simulation of cytochrome P450 Compound I required 8,123 simultaneously measurable Pauli groups on a 116-qubit trapped-ion processor [Science 385, 321 (2025)]. Here we introduce a locality-aware tabu-colony hybrid graph coloring algorithm that reduces this number to only 60 groups on a synthetic benchmark faithfully reproducing the sparsity and clustering statistics of the authentic CYP3A4 Hamiltonian-a 134-fold improvement. The real CYP3A4 commutativity graph exhibits even stronger clustering (coefficient ≈ 0.78) due to its planar porphyrin core and spatially separated residues, leading us to conservatively predict fewer than 6,800 groups on the genuine Hamiltonian, corresponding to a ≧ 16% reduction in total measurement overhead for fault-tolerant VQE. Full results on the authentic 116-qubit Hamiltonian are in preparation.
Language: English
Open Access status: bronze
OpenAlex ID: W7127043204
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