Eckart axis conditions and the minimization of the root-mean-square deviation: Two closely related problems
Eckart axis conditions and the minimization of the root-mean-square deviation: Two closely related problems
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DOI：
10.1063/1.1929739
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发表时间：
2005-06-08
影响因子：
4.4
通讯作者：
Dymarsky, AY
中科院分区：
文献类型：
--
作者：
Kudin, KN;Dymarsky, AY
我们强调了这样一个事实，即使两个分子构象之间的均方根偏差最小的旋转矩阵也满足埃卡特轴条件。
We highlight the fact that the rotation matrix minimizing the root-mean-square deviation between two molecular conformations also satisfies the Eckart axis conditions.