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本文采用B3LYP/DZP++方法应用Gaussian03 程序研究了腺嘌呤-胸腺嘧啶(A-T)碱基对阴离子的单质子转移机理以及金属Cu2+对AT-碱基对质子转移的影响.
Cu2+对ATˉ碱基对质子转移的影响
【摘 要】
：
本文采用B3LYP/DZP++方法应用Gaussian03 程序研究了腺嘌呤-胸腺嘧啶(A-T)碱基对阴离子的单质子转移机理以及金属Cu2+对AT-碱基对质子转移的影响.
【机 构】
：
西南交通大学物理科学与技术学院,成都610031
【出 处】
：
第十六届全国原子与分子物理学术会议
【发表日期】
：
2011年8期
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