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. 2024 Jul 3;14(29):21035–21046. doi: 10.1039/d4ra03222e

Stereoisomer's pij(x) integral having the largest value at the denominator for each simulation. Values in brackets are computed as a ratio between pij(x) integrals for simulations A and B divided by the result for the same stereochemistry computed for simulation C (enhancement).

Encounter stereochemistry Simulation A Simulation B Simulation C
(Si,Re) 0.66 (4.08) 0.85 (3.92) 0.35
(Si,Si) 0.71 (3.35) 0.85 (3.13) 0.44
(Re,Re) 1.0 (3.45) 1.0 (2.57) 0.63
(Re,Si) 0.74 (1.59) 0.95 (1.53) 1.0