Then, based on the structure, the electronic structure of amino acid with the potential of water molecules is calculated using the self-consistent cluster-embedding (SCCE) method.
然后以此空间构型为基础,用“团簇埋入自洽计算法”计算氨基酸在以水分子为外势条件下的电子结构。
Then, based on the structure, the electronic structure of amino acid with the potential of water molecules is calculated using the self-consistent cluster-embedding (SCCE) method.
然后以此空间构型为基础,用“团簇埋入自洽计算法”计算氨基酸在以水分子为外势条件下的电子结构。
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