(μ-oxo) :

Kisoo Park1, Youngshang Pak, Yongho Kim

  • 1Department of Applied Chemistry, Kyung Hee University, 1 Seochun-Dong, Giheung-Gu, Yongin-Si, Gyeonggi-Do 446-701, Korea.

まとめ

量子計算は,二銅酵素モデルにおける動的同位体効果を正確に予測し,C-H結合の活性化中に重要な水素トンネリングを明らかにします. このトンネリングは,効率的な水素転送機構を強調して,最小エネルギー経路と大きく異なる.

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